sampleid m/z RT Adduct Compound_Name MassDiff ATTRIBUTE_16s_ID ATTRIBUTE_16S_shortID ATTRIBUTE_Country ATTRIBUTE_IndusScore ATTRIBUTE_NumIndusScore ATTRIBUTE_OriginalFileName ATTRIBUTE_Population ATTRIBUTE_SampleID charge cluster index componentindex Compound_Name Compound_Source Data_Collector GNPSGROUP:BurkinaFaso GNPSGROUP:Guayabo GNPSGROUP:Isolated Traditional (4) GNPSGROUP:Matses GNPSGROUP:Norman GNPSGROUP:Peru GNPSGROUP:Rural Industrial (2) GNPSGROUP:Rural Traditional (3) GNPSGROUP:TamboDeMora GNPSGROUP:Tunapuco GNPSGROUP:Urban Industrial (1) GNPSGROUP:USA GNPSLibraryURL GNPSLinkout_Cluster GNPSLinkout_Network Instrument Ion_Source IonMode Library_Class MassDiff MQScore MZErrorPPM name number of spectra parent mass PI RTMean shared name SharedPeaks Smiles SpectrumID sum(precursor intensity) 137.046_0.3805 137.046 0.3805 M+H HYPOXANTHINE 0.0039978 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 11178 239 HYPOXANTHINE Commercial standard Prasad 3287.253717 3086.928938 NA 3232.343733 1780.195425 NA NA NA 2341.534378 3308.863934 1780.195425 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00000577903 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""11178.0"",""main.cluster index_upperinput"":""11178.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=239&task=45672509f37244b89c33d0afe8935c88&show=true Q-Exactive Plus LC-ESI Positive 1 0.0039978 0.975775 29.1704 11178 108 137.046 Alexandrov Theodore 0.3805 11178 5 C1=NC2=C(N1)C(=O)N=CN2 CCMSLIB00000577903 308143.7386 139.0503_0.3108 139.0503 0.3108 M+H Spectral Match to Nicotinamide N-oxide from NIST14 0.000289917 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 1791 -1 Spectral Match to Nicotinamide N-oxide from NIST14 Isolated Data deposited by mjmeehan 556.2729524 958.0821205 NA 625.2442196 684.3900649 NA NA NA 663.1911842 785.1071473 684.3900649 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136964 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""1791.0"",""main.cluster index_upperinput"":""1791.0""}" This Node is a Singleton IT/ion trap ESI Positive 3 0.000289917 0.999779 2.08498 1791 108 139.0503 Data from Gabriel Haddad 0.3108 1791 8 N/A CCMSLIB00003136964 75862.31072 148.0759_3.2191 148.0759 3.2191 M+H 3-METHYL-2-OXINDOLE 0.000106812 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 4056 596 3-METHYL-2-OXINDOLE Commercial Fernando Vargas 212.78854 106.0768954 NA 107.3272897 57.71567023 NA NA NA 96.86660084 128.5895288 57.71567023 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005463646 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4056.0"",""main.cluster index_upperinput"":""4056.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=596&task=45672509f37244b89c33d0afe8935c88&show=true Orbitrap ESI Positive 1 0.000106812 0.926001 0.721329 4056 107 148.0759 Dorrestein 3.2191 4056 6 CC1C2=CC=CC=C2NC1=O CCMSLIB00005463646 12013.46654 195.0651_3.0126 195.0651 3.0126 M+H Spectral Match to trans-Ferulic acid from NIST14 9.16E-05 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 8500 165 Spectral Match to trans-Ferulic acid from NIST14 Isolated Data deposited by amelnik 9.142905189 10.95795092 NA 79.3812195 23.49560097 NA NA NA 11.48764718 57.9869729 23.49560097 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137490 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""8500.0"",""main.cluster index_upperinput"":""8500.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=165&task=45672509f37244b89c33d0afe8935c88&show=true Q-TOF ESI Positive 3 9.16E-05 0.911395 0.469345 8500 107 195.0651 Data from Rob Knight 3.0126 8500 5 N/A CCMSLIB00003137490 3871.357412 245.0983_2.3864 245.0983 2.3864 [M+H]+ BIOTIN 0.0032959 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 24636 2344 BIOTIN isolated MoNA:VF-NPL-QEHF028111 4.515143699 1.645258231 NA 3.247397651 4.589561014 NA NA NA 3.481700531 6.144073684 4.589561014 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00004721692 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""24636.0"",""main.cluster index_upperinput"":""24636.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=2344&task=45672509f37244b89c33d0afe8935c88&show=true ESI-QFT N/A positive 3 0.0032959 0.867222 13.4474 24636 106 245.0983 MoNA 2.3864 24636 6 N/A CCMSLIB00004721692 452.0527228 263.2369_6.6799 263.2369 6.6799 M+H-H2O "Spectral Match to Conjugated linoleic acid (9E,11E) from NIST14" 9.16E-05 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 5499 335 "Spectral Match to Conjugated linoleic acid (9E,11E) from NIST14" Isolated Data deposited by amelnik 50.57413483 14.22096432 NA 24.39415133 28.23868293 NA NA NA 31.26233591 34.6367702 28.23868293 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136691 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""5499.0"",""main.cluster index_upperinput"":""5499.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=335&task=45672509f37244b89c33d0afe8935c88&show=true HCD ESI Positive 3 9.16E-05 0.919096 0.347796 5499 108 263.2369 Data from P.Dorrestein 6.6799 5499 10 N/A CCMSLIB00003136691 3217.37545 272.1711_0.3211 272.1711 0.3211 M+H Spectral Match to Pro-Arg from NIST14 0.00012207 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 11602 -1 Spectral Match to Pro-Arg from NIST14 Isolated Data deposited by fevargas 12.58430183 11.79805052 NA 31.12912398 15.54470568 NA NA NA 15.80852711 24.21593788 15.54470568 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137278 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""11602.0"",""main.cluster index_upperinput"":""11602.0""}" This Node is a Singleton Q-TOF ESI Positive 3 0.00012207 0.720953 0.448506 11602 98 272.1711 Data from Christopher A. Lowry 0.3211 11602 8 N/A CCMSLIB00003137278 2064.89576 391.188_5.247 391.188 5.247 M-2H2O+H """(6R)-2-(hydroxymethyl)-6-((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptanoic acid""" 0.00158691 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 14059 485 """(6R)-2-(hydroxymethyl)-6-((3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)heptanoic acid""" crude Emily Gentry 64.56232761 12.02330053 NA 6.837557082 13.45614515 NA NA NA 18.17696299 7.954304517 13.45614515 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005465846 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=45672509f37244b89c33d0afe8935c88&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""14059.0"",""main.cluster index_upperinput"":""14059.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=485&task=45672509f37244b89c33d0afe8935c88&show=true qTof ESI Positive 1 0.00158691 0.864316 3.67924 14059 105 391.188 Dorrestein 431.3176 14059 18 C[C@@H]([C@H]1CC[C@]2([H])[C@]1(C)[C@@H](O)C[C@@]3([H])[C@@]2([H])[C@H](O)C[C@]4([H])[C@]3(C)CC[C@@H](O)C4)CCCC(CO)C(O)=O CCMSLIB00005465846 1765.737543 314.2699_7.3373 314.2699 7.3373 M+H Spectral Match to N-Palmitoylglycine from NIST14 0.00189209 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 19209 383 Spectral Match to N-Palmitoylglycine from NIST14 Isolated Data deposited by mjmeehan 2.57055801 0.74362775 NA 1.604878946 0.490755632 NA NA NA 1.106978946 1.317783866 0.490755632 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003140124 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=da2a1bf6bb58455690219c0abc637a44&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""19209.0"",""main.cluster index_upperinput"":""19209.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=383&task=da2a1bf6bb58455690219c0abc637a44&show=true HCD ESI Positive 3 0.00189209 0.859573 6.02063 19209 102 314.2699 Data from Jessica Metcalf 7.3373 19209 6 N/A CCMSLIB00003140124 130.8071214 263.1405_3.0215 263.1405 3.0215 M+H Spectral Match to Met-Leu from NIST14 0.00149536 NA NA "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" NA "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" NA 0 7911 2983 Spectral Match to Met-Leu from NIST14 Isolated Data deposited by fevargas 6.129195799 6.7460716 NA 8.951470203 2.858661516 NA NA NA 7.233775309 7.473542786 2.858661516 NA http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003139611 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=da2a1bf6bb58455690219c0abc637a44&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""7911.0"",""main.cluster index_upperinput"":""7911.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=2983&task=da2a1bf6bb58455690219c0abc637a44&show=true Q-TOF ESI Positive 3 0.00149536 0.907455 5.68272 7911 104 263.1405 Data from Chris Turck 3.0215 7911 11 N/A CCMSLIB00003139611 696.9799789 158.154_4.7767 158.154 4.7767 M+H hyocholic acid 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 11358 -1 hyocholic acid commercial A. Jarmusch 32.98041877 34.22264428 29.86369996 29.86369996 22.57190779 28.39204453 32.54266951 26.01172453 31.25798292 23.45653665 22.57190779 22.57190779 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005435541 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""11358.0"",""main.cluster index_upperinput"":""11358.0""}" This Node is a Singleton Orbitrap ESI Positive 1 0 0.826752 0 11358 105 158.154 Dorrestein 4.7767 11358 4 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H]([C@@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C CCMSLIB00005435541 2926.874331 175.1071_0.3625 175.1071 0.3625 M+H Spectral Match to Gly-Val from NIST14 0.000900269 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 34807 1153 Spectral Match to Gly-Val from NIST14 Isolated Data deposited by fevargas 113.3282374 149.9836347 191.5651914 191.5651914 171.0364326 165.9198465 139.0079673 161.493582 130.61481 179.1542083 171.0364326 171.0364326 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003139056 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""34807.0"",""main.cluster index_upperinput"":""34807.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1153&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000900269 0.92027 5.14122 34807 105 175.1071 Data from Chris Turck 0.3625 34807 6 N/A CCMSLIB00003139056 16935.17473 177.0547_4.1326 177.0547 4.1326 M+H-H2O Spectral Match to 3-Hydroxy-4-methoxycinnamic acid from NIST14 0.000701904 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 31028 1433 Spectral Match to 3-Hydroxy-4-methoxycinnamic acid from NIST14 Isolated Data deposited by pmallard 4.277089036 9.567738601 16.35150833 16.35150833 5.326927094 12.61862526 6.138228708 13.66567084 3.515662319 17.10815084 5.326927094 5.326927094 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003135300 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""31028.0"",""main.cluster index_upperinput"":""31028.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1433&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0.000701904 0.96846 3.96435 31028 104 177.0547 Data from Wolfender/Litaudon 4.1326 31028 5 N/A CCMSLIB00003135300 1101.948187 181.0721_0.807 181.0721 0.807 M+H PARAXANTHINE 9.16E-05 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4572 878 PARAXANTHINE Commercial Kelly Weldon 45.47045344 9.621088811 0.487675704 0.487675704 66.28657715 3.329072033 7.59010713 12.62630335 6.037003492 0.583448311 66.28657715 66.28657715 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005464250 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4572.0"",""main.cluster index_upperinput"":""4572.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=878&task=23bd059303474899a926ea61cc56c1d8&show=true Orbitrap ESI Positive 1 9.16E-05 0.933165 0.505615 4572 105 181.0721 Dorrestein 0.807 4572 5 CN1C=NC2=C1C(=O)N(C)C(=O)N2 CCMSLIB00005464250 1946.342851 263.1406_1.2957 263.1406 1.2957 M+H Spectral Match to Phe-Pro from NIST14 0.00259399 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4857 206 Spectral Match to Phe-Pro from NIST14 Isolated Data deposited by fevargas 89.13833419 239.7246473 37.90480555 37.90480555 91.07656858 117.7825546 215.7981538 69.55059319 197.5014236 62.36842149 91.07656858 91.07656858 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138008 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4857.0"",""main.cluster index_upperinput"":""4857.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=206&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0.00259399 0.99314 9.85792 4857 105 263.1406 Data from Joshua Wollam 1.2957 4857 6 N/A CCMSLIB00003138008 11571.37406 197.1165_3.0981 197.1165 3.0981 M+H Loliolide 0.00050354 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,TU074,GU011,TU053,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,bftm0101,TM026,GU013,TM010,HCO07,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF09_02_BF3.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,HCO01,GU6,31TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,HCO66,SM33,NO6" 0 9973 323 Loliolide Crude Daniel Petras 5.103241116 7.073414678 5.65654255 5.65654255 1.279418092 8.868275742 5.645392817 11.46971081 4.553376099 13.80408304 1.279418092 1.279418092 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00004680136 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""9973.0"",""main.cluster index_upperinput"":""9973.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=323&task=23bd059303474899a926ea61cc56c1d8&show=true Orbitrap LC-ESI Positive 3 0.00050354 0.736411 2.55452 9973 97 197.1165 Lihini Aluwihare 3.0981 9973 5 CC1(CC(CC2(C1=CC(=O)O2)C)O)C CCMSLIB00004680136 753.1541344 204.0868_3.5276 204.0868 3.5276 M+H-H2O Spectral Match to N-Acetyl-D-mannosamine from NIST14 0.000198364 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 21622 957 Spectral Match to N-Acetyl-D-mannosamine from NIST14 Isolated Data deposited by fevargas 8.613945017 37.24507572 69.50050324 69.50050324 12.19796501 44.6787648 37.58991626 30.50326781 37.85361785 38.52935284 12.19796501 12.19796501 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003134781 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""21622.0"",""main.cluster index_upperinput"":""21622.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=957&task=23bd059303474899a926ea61cc56c1d8&show=true HCD ESI Positive 3 0.000198364 0.881377 0.971959 21622 105 204.0868 Data from Chris Turck 3.5276 21622 5 N/A CCMSLIB00003134781 3709.90289 208.097_2.8411 208.097 2.8411 M+H "Spectral Match to L-Phenylalanine, N-acetyl- from NIST14" 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4115 270 "Spectral Match to L-Phenylalanine, N-acetyl- from NIST14" Isolated Data deposited by amelnik 108.1183716 61.97238208 66.49651456 66.49651456 23.87748729 58.96561436 70.26988966 60.94263063 76.61504252 43.64485894 23.87748729 23.87748729 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137364 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4115.0"",""main.cluster index_upperinput"":""4115.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=270&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0 0.950148 0 4115 105 208.097 Data from Rob Knight 2.8411 4115 5 N/A CCMSLIB00003137364 6100.48355 217.1224_0.4618 217.1224 0.4618 M+H Spectral Match to Thr-Pro from NIST14 0.00440979 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 19711 1728 Spectral Match to Thr-Pro from NIST14 Isolated Data deposited by fevargas 4.965265895 4.441027403 4.712057443 4.712057443 2.36439234 4.052301603 3.752128017 4.259416757 3.225322605 4.000605406 2.36439234 2.36439234 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136952 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""19711.0"",""main.cluster index_upperinput"":""19711.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1728&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00440979 0.946712 20.3106 19711 104 217.1224 Data from Chris Turck 0.4618 19711 7 N/A CCMSLIB00003136952 405.1519088 217.155_0.4485 217.155 0.4485 M+H Spectral Match to Val-Val from NIST14 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4311 533 Spectral Match to Val-Val from NIST14 Isolated Data deposited by fevargas 822.9642727 263.6463644 1141.66769 1141.66769 561.7650639 762.3133535 356.2080596 927.6950496 426.9905324 966.0963344 561.7650639 561.7650639 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138752 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4311.0"",""main.cluster index_upperinput"":""4311.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=533&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0 0.971547 0 4311 105 217.155 Data from Joshua Wollam 0.4485 4311 6 N/A CCMSLIB00003138752 77100.19302 219.1134_0.6005 219.1134 0.6005 M+H Spectral Match to Abrine from NIST14 0.00340271 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 10582 666 Spectral Match to Abrine from NIST14 Isolated Data deposited by rsilva 6.602985457 7.522099003 1.310940174 1.310940174 6.10713635 3.203274127 6.101294729 2.733360709 5.014797342 1.314498301 6.10713635 6.10713635 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136235 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""10582.0"",""main.cluster index_upperinput"":""10582.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=666&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0.00340271 0.880148 15.5297 10582 105 219.1134 Data from Rob Knight 0.6005 10582 6 N/A CCMSLIB00003136235 426.010128 220.1183_0.5571 220.1183 0.5571 M+H Spectral Match to Pantothenic acid from NIST14 0.000305176 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 25357 848 Spectral Match to Pantothenic acid from NIST14 Isolated Data deposited by fevargas 463.4435411 499.9319146 372.2814819 372.2814819 333.9836037 433.1091053 415.463169 477.8968824 350.8694224 483.1964408 333.9836037 333.9836037 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138376 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""25357.0"",""main.cluster index_upperinput"":""25357.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=848&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000305176 0.715669 1.38642 25357 105 220.1183 Data from Christopher A. Lowry 0.5571 25357 6 N/A CCMSLIB00003138376 44025.87582 227.1032_0.4277 227.1032 0.4277 M+H Spectral Match to PyroGlu-Pro from NIST14 0.000198364 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 5512 547 Spectral Match to PyroGlu-Pro from NIST14 Isolated Data deposited by lfnothias 24.3057661 41.05242989 31.5950385 31.5950385 37.38418997 35.28431067 39.91445697 30.39065153 39.04424239 32.62177618 37.38418997 37.38418997 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003135898 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""5512.0"",""main.cluster index_upperinput"":""5512.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=547&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000198364 0.843925 0.873455 5512 104 227.1032 Data from Pieter Dorrestein 0.4277 5512 4 N/A CCMSLIB00003135898 3621.886457 229.155_0.7773 229.155 0.7773 M+H Spectral Match to Ile-Pro from NIST14 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 41623 206 Spectral Match to Ile-Pro from NIST14 Isolated Data deposited by fevargas 2859.407162 2813.762791 4631.665684 4631.665684 3298.28666 3766.982969 2799.475791 3893.981945 2788.550438 4273.326032 3298.28666 3298.28666 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138780 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""41623.0"",""main.cluster index_upperinput"":""41623.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=206&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0 0.985019 0 41623 105 229.155 Data from Joshua Wollam 0.7773 41623 8 N/A CCMSLIB00003138780 377113.3443 231.171_2.8229 231.171 2.8229 M+H Spectral Match to Val-Ile from NIST14 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 33670 1023 Spectral Match to Val-Ile from NIST14 Isolated Data deposited by mjmeehan 387.2563082 78.45320347 390.5512561 390.5512561 95.66495103 208.9187158 88.28657077 274.1518187 95.80620458 232.6801726 95.66495103 95.66495103 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003134815 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""33670.0"",""main.cluster index_upperinput"":""33670.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1023&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0 0.880066 0 33670 105 231.171 Data from Gabriel Haddad 2.8229 33670 6 N/A CCMSLIB00003134815 21859.61091 237.2214_6.4871 237.2214 6.4871 M+H-H2O Spectral Match to cis-9-Hexadecenoic acid from NIST14 0.000595093 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 8827 416 Spectral Match to cis-9-Hexadecenoic acid from NIST14 Isolated Data deposited by pmallard 4.431091676 3.01501959 15.64917887 15.64917887 10.42383714 5.822509837 3.752701538 3.128898732 4.316811263 2.651427985 10.42383714 10.42383714 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137000 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""8827.0"",""main.cluster index_upperinput"":""8827.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=416&task=23bd059303474899a926ea61cc56c1d8&show=true HCD ESI Positive 3 0.000595093 0.959841 2.50859 8827 105 237.2214 Data from Wolfender/Litaudon 6.4871 8827 10 N/A CCMSLIB00003137000 678.8818246 255.2324_5.9615 255.2324 5.9615 M+H Spectral Match to Palmitelaidic acid from NIST14 0.000411987 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 9966 2546 Spectral Match to Palmitelaidic acid from NIST14 Isolated Data deposited by pmallard 6.868039787 6.354276434 3.968017895 3.968017895 1.614021967 5.532456736 4.510208288 7.249283285 3.10003853 7.389072567 1.614021967 1.614021967 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136157 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""9966.0"",""main.cluster index_upperinput"":""9966.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=2546&task=23bd059303474899a926ea61cc56c1d8&show=true HCD ESI Positive 3 0.000411987 0.915566 1.61417 9966 105 255.2324 Data from Wolfender/Litaudon 5.9615 9966 10 N/A CCMSLIB00003136157 525.067545 239.1021_0.4404 239.1021 0.4404 M+H Spectral Match to Gly-Tyr from NIST14 9.16E-05 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 6112 4631 Spectral Match to Gly-Tyr from NIST14 Isolated Data deposited by fevargas 6.166179063 21.02436 76.21047317 76.21047317 18.11290264 49.03154407 25.46409935 44.16914068 28.85919415 58.10355994 18.11290264 18.11290264 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136179 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""6112.0"",""main.cluster index_upperinput"":""6112.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=4631&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 9.16E-05 0.94841 0.382902 6112 104 239.1021 Data from Chris Turck 0.4404 6112 8 N/A CCMSLIB00003136179 4120.257567 245.1862_2.3952 245.1862 2.3952 M+H Spectral Match to Leu-Leu from NIST14 0.000198364 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4395 533 Spectral Match to Leu-Leu from NIST14 Isolated Data deposited by mjmeehan 227.9159642 112.9508406 651.8820708 651.8820708 173.6402863 406.1245297 184.169801 424.8129927 238.631359 497.0085698 173.6402863 173.6402863 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003139983 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4395.0"",""main.cluster index_upperinput"":""4395.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=533&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000198364 0.98282 0.809036 4395 105 245.1862 Data from Gabriel Haddad 2.3952 4395 7 N/A CCMSLIB00003139983 36498.06502 247.1448_1.2228 247.1448 1.2228 [M+H]+ lenticin 0.000808716 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 39211 1891 lenticin isolated MoNA:VF-NPL-QEHF001171 21.20661844 3.702767669 1.877336562 1.877336562 9.440551482 2.712325475 5.08419818 6.264541673 6.140586219 0.785780191 9.440551482 9.440551482 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00004692234 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""39211.0"",""main.cluster index_upperinput"":""39211.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1891&task=23bd059303474899a926ea61cc56c1d8&show=true ESI-QFT N/A positive 3 0.000808716 0.978977 3.27225 39211 105 247.1448 MoNA 1.2228 39211 8 N/A CCMSLIB00004692234 609.3394657 249.1264_0.5559 249.1264 0.5559 M+H Spectral Match to Val-Met from NIST14 0.000396729 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 36896 4995 Spectral Match to Val-Met from NIST14 Isolated Data deposited by fevargas 65.65715404 34.25423662 66.81109076 66.81109076 72.81767458 60.68550279 40.55632627 74.35755284 45.3755713 77.54769907 72.81767458 72.81767458 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138480 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""36896.0"",""main.cluster index_upperinput"":""36896.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=4995&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000396729 0.959099 1.59248 36896 105 249.1264 Data from Chris Turck 0.5559 36896 9 N/A CCMSLIB00003138480 6645.045049 253.1183_0.7932 253.1183 0.7932 M+H Spectral Match to Ser-Phe from NIST14 0.000305176 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 8336 2706 Spectral Match to Ser-Phe from NIST14 Isolated Data deposited by mjmeehan 22.06787589 22.55426072 48.98410268 48.98410268 35.86289918 37.21427016 31.06768332 33.0550006 37.57794766 37.08361299 35.86289918 35.86289918 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138137 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""8336.0"",""main.cluster index_upperinput"":""8336.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=2706&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000305176 0.929581 1.20567 8336 105 253.1183 Data from Gabriel Haddad 0.7932 8336 11 N/A CCMSLIB00003138137 3716.563352 259.1293_0.3061 259.1293 0.3061 M+H-H2O Spectral Match to L-Saccharopine from NIST14 0.000305176 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4810 1443 Spectral Match to L-Saccharopine from NIST14 Isolated Data deposited by lfnothias 28.10904798 14.71176721 5.041847557 5.041847557 21.73057752 13.41666298 17.11250863 17.92246572 18.94836972 14.18738556 21.73057752 21.73057752 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138645 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4810.0"",""main.cluster index_upperinput"":""4810.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1443&task=23bd059303474899a926ea61cc56c1d8&show=true HCD ESI Positive 3 0.000305176 0.790962 1.1777 4810 105 259.1293 Data from Pieter Dorrestein 0.3061 4810 4 N/A CCMSLIB00003138645 1720.01631 263.237_7.5172 263.237 7.5172 M+H-H2O "Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14" 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 8498 -1 "Spectral Match to Conjugated linoleic Acid (10E,12Z) from NIST14" Isolated Data deposited by amelnik 12.34686545 4.900461356 9.51581423 9.51581423 11.46320517 10.55368137 6.37807408 14.49512326 7.508013221 15.2828178 11.46320517 11.46320517 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136426 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""8498.0"",""main.cluster index_upperinput"":""8498.0""}" This Node is a Singleton HCD ESI Positive 3 0 0.845273 0 8498 105 263.237 Data from P.Dorrestein 7.5172 8498 8 N/A CCMSLIB00003136426 1144.232997 267.1342_0.4803 267.1342 0.4803 M+H Spectral Match to Thr-Phe from NIST14 0.000183105 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4443 699 Spectral Match to Thr-Phe from NIST14 Isolated Data deposited by fevargas 64.06021532 20.22075562 33.59831419 33.59831419 36.09713638 37.46696986 31.6348446 50.37887104 40.36326559 45.36237814 36.09713638 36.09713638 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003139262 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4443.0"",""main.cluster index_upperinput"":""4443.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=699&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000183105 0.931713 0.685444 4443 105 267.1342 Data from Chris Turck 0.4803 4443 9 N/A CCMSLIB00003139262 4201.900533 275.201_4.4249 275.201 4.4249 M+H-H2O Spectral Match to 9-OxoOTrE from NIST14 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 8486 434 Spectral Match to 9-OxoOTrE from NIST14 Isolated Data deposited by pmallard 7.112174726 3.422522768 4.953834063 4.953834063 2.583868612 2.981534633 2.825533896 3.434224201 2.369012993 2.085642342 2.583868612 2.583868612 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003139019 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""8486.0"",""main.cluster index_upperinput"":""8486.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=434&task=23bd059303474899a926ea61cc56c1d8&show=true IT-FT/ion trap with FTMS ESI Positive 3 0 0.820595 0 8486 105 275.201 Data from Wolfender/Litaudon 4.4249 8486 9 N/A CCMSLIB00003139019 351.3401891 279.1707_2.5868 279.1707 2.5868 M+H Spectral Match to Phe-Leu from NIST14 0.000671387 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4457 533 Spectral Match to Phe-Leu from NIST14 Isolated Data deposited by fevargas 81.53009092 61.14806009 183.1541584 183.1541584 121.0850799 139.0872852 97.78178333 136.6718205 125.795807 156.8904547 121.0850799 121.0850799 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003134492 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4457.0"",""main.cluster index_upperinput"":""4457.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=533&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000671387 0.987208 2.40494 4457 105 279.1707 Data from Chris Turck 2.5868 4457 9 N/A CCMSLIB00003134492 13646.99611 279.1708_3.4667 279.1708 3.4667 M+H Spectral Match to Leu-Phe from NIST14 0.000793457 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4500 533 Spectral Match to Leu-Phe from NIST14 Isolated Data deposited by fevargas 80.03221439 25.85863563 123.6630909 123.6630909 35.63704012 57.96219856 25.59368124 61.92833067 25.39106906 55.29023997 35.63704012 35.63704012 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137982 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4500.0"",""main.cluster index_upperinput"":""4500.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=533&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000793457 0.97465 2.8422 4500 104 279.1708 Data from Joshua Wollam 3.4667 4500 7 N/A CCMSLIB00003137982 5926.948171 285.0831_0.4016 285.0831 0.4016 M+H Spectral Match to Xanthosine from NIST14 0.00109863 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4508 708 Spectral Match to Xanthosine from NIST14 Isolated Data deposited by fevargas 38.37106831 14.45612013 20.82243689 20.82243689 8.742494826 24.25053788 14.89176476 36.22465115 15.22490477 35.43763153 8.742494826 8.742494826 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138293 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4508.0"",""main.cluster index_upperinput"":""4508.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=708&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00109863 0.900921 3.85374 4508 104 285.0831 Data from Joshua Wollam 0.4016 4508 7 N/A CCMSLIB00003138293 2422.487537 288.2028_0.3645 288.2028 0.3645 M+H Spectral Match to Arg-Ile from NIST14 0.000793457 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4652 601 Spectral Match to Arg-Ile from NIST14 Isolated Data deposited by fevargas 39.51786868 29.07878551 266.6082142 266.6082142 37.46426012 166.4272259 64.33230261 167.9869566 91.29087452 215.0922888 37.46426012 37.46426012 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003140066 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4652.0"",""main.cluster index_upperinput"":""4652.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=601&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000793457 0.906391 2.75313 4652 105 288.2028 Data from Julia Gauglitz 0.3645 4652 12 N/A CCMSLIB00003140066 13757.52241 282.2791_6.0892 282.2791 6.0892 M+H-C24H44O-H2O Spectral Match to N-Tetracosenoyl-4-sphingenine from NIST14 0.00012207 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,TM001,HCO10,TU062,TM006a,SM029,TU072,NO003,TU068,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,1GU.mzXML,26TM.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,GU16,GU19,HCO07,HCO72,HCO13,TM22_03,GU12,HCO62,SM10,HCO68,HCO64,NO23,HCO66,SM33,NO6" 0 15655 137 Spectral Match to N-Tetracosenoyl-4-sphingenine from NIST14 Isolated Data deposited by pmallard 1.572196094 2.271261214 1.486598141 1.486598141 4.166022938 1.996952102 2.569412312 1.663282371 2.79741021 1.696680673 4.166022938 4.166022938 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003135022 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""15655.0"",""main.cluster index_upperinput"":""15655.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=137&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0.00012207 0.797933 0.432446 15655 97 282.2791 Data from Wolfender/Litaudon 6.0892 15655 7 N/A CCMSLIB00003135022 244.0509297 294.1191_0.3764 294.1191 0.3764 [M+H]+ N-Acetylmuramic Acid 0.00109863 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 9104 265 N-Acetylmuramic Acid isolated MoNA:VF-NPL-QEHF027064 128.7984844 211.0940533 144.7173831 144.7173831 33.96266279 198.7744974 191.1131469 206.7017707 175.8336302 235.266309 33.96266279 33.96266279 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00004720645 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""9104.0"",""main.cluster index_upperinput"":""9104.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=265&task=23bd059303474899a926ea61cc56c1d8&show=true ESI-QFT N/A positive 3 0.00109863 0.887685 3.73535 9104 104 294.1191 MoNA 0.3764 9104 7 N/A CCMSLIB00004720645 17134.97306 295.1636_2.7068 295.1636 2.7068 M+H Spectral Match to Tyr-Leu from NIST14 0.00140381 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 5872 5146 Spectral Match to Tyr-Leu from NIST14 Isolated Data deposited by fevargas 5.226853418 3.30954847 10.13073311 10.13073311 5.096310644 6.911653022 4.331442375 7.091366249 5.112890655 7.775020954 5.096310644 5.096310644 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003135895 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""5872.0"",""main.cluster index_upperinput"":""5872.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=5146&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00140381 0.96935 4.75601 5872 104 295.1636 Data from Chris Turck 2.7068 5872 10 N/A CCMSLIB00003135895 674.5146089 297.1261_3.1402 297.1261 3.1402 M+H Spectral Match to Phe-Met from NIST14 9.16E-05 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,GU017,bftm0902,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,bftm2901,GU016,SM030,SM034,TM001,HCO10,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,HCO53,HCO61,SM11,HCO21,HCO18,SM28,1TM,GU4,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,GU6,31TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33" 0 8050 442 Spectral Match to Phe-Met from NIST14 Isolated Data deposited by fevargas 4.163094706 1.712242642 1.668202571 1.668202571 0.742673758 1.605672467 1.500170483 2.344604722 1.337997655 1.677825062 0.742673758 0.742673758 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137489 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""8050.0"",""main.cluster index_upperinput"":""8050.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=442&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 9.16E-05 0.937014 0.308128 8050 96 297.1261 Data from Chris Turck 3.1402 8050 7 N/A CCMSLIB00003137489 181.1932769 302.2048_3.0495 302.2048 3.0495 M+H Spectral Match to Ile-Gly-Ile from NIST14 0.00219727 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 23048 268 Spectral Match to Ile-Gly-Ile from NIST14 Isolated Data deposited by fevargas 3.269026206 0.731264116 0.882652951 0.882652951 1.518328792 1.231931768 1.211323681 1.929852317 1.578428054 1.438821891 1.518328792 1.518328792 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003139641 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""23048.0"",""main.cluster index_upperinput"":""23048.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=268&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0.00219727 0.938527 7.27073 23048 105 302.2048 Data from Joshua Wollam 3.0495 23048 12 N/A CCMSLIB00003139641 156.9160209 291.268_5.5386 291.268 5.5386 M+H-H2O "Spectral Match to cis-11,14-Eicosadienoic acid from NIST14" 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.MIS2.FEC.V4R.TU016,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,PMB.L007.FEC.V4R.TM031,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,CNA.NOR.FEC.V4R.NO019,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU063,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,TU053,GU010,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM010,bftm2203,TU065,NO011,GU006,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TU016,TU041,GU019,TM003,bftm2901,GU016,HCO10,TU062,SM029,TU072,NO010,TU068,TM016,TU069,TU067,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,HCO64.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,16GU.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,HCO65.mzXML,26TM.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,SM10.mzXML,HCO14.mzXML,BF22_03_BF3.mzXML,NO02_NO2.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,HCO53,NO21,SM11,HCO18,HCO16,SM41,HCO03,NO20,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU7,26TM,TM29_01,SM37,28TM,HCO14,NO22,3TM,HCO63,16TM,SM29,HCO12,4TM,GU2,10TM,GU10,TM11_04,HCO11,GU13,NO19,NO9,HCO01,GU6,31TM,NO1,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,GU20,NO4,11TM,HCO67,TM20_03,GU17,NO11,SM03,HCO17,NO8,NO5,NO10,GU16,GU19,HCO07,HCO65,HCO72,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,NO23,SM33,NO6" 0 29829 1760 "Spectral Match to cis-11,14-Eicosadienoic acid from NIST14" Isolated Data deposited by amelnik 0.593025848 2.331558867 0.055688037 0.055688037 3.622817843 1.08682928 2.03495843 0.662988978 1.808146331 0.688642126 3.622817843 3.622817843 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138426 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""29829.0"",""main.cluster index_upperinput"":""29829.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1760&task=23bd059303474899a926ea61cc56c1d8&show=true HCD ESI Positive 3 0 0.740798 0 29829 75 291.268 Data from P.Dorrestein 5.5386 29829 6 N/A CCMSLIB00003138426 154.3330308 304.1663_3.017 304.1663 3.017 M+H Spectral Match to Val-Trp from NIST14 0.00128174 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,NO002,TU017,TU003,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,bftm2901,GU016,SM030,SM034,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,SM37.mzXML,NO05_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,NO02_NO2.mzXML,18TM.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,GU4,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,SM37,27TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 4715 769 Spectral Match to Val-Trp from NIST14 Isolated Data deposited by mjmeehan 31.31470021 10.06018113 24.86869964 24.86869964 6.541337685 13.39388658 9.066930153 16.8899996 8.307385286 11.60094271 6.541337685 6.541337685 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136202 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""4715.0"",""main.cluster index_upperinput"":""4715.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=769&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00128174 0.973481 4.21396 4715 99 304.1663 Data from Gabriel Haddad 3.017 4715 12 N/A CCMSLIB00003136202 1480.141161 309.1635_0.3129 309.1635 0.3129 M+H Fructoselysine 0.00332642 "PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,NO006,GU017,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 12142 725 Fructoselysine Commercial Alesia Walker 4.936635797 7.062894303 17.86486828 17.86486828 6.346949833 9.3706546 5.260639625 7.873552733 3.882444872 8.950422276 6.346949833 6.346949833 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005720267 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""12142.0"",""main.cluster index_upperinput"":""12142.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=725&task=23bd059303474899a926ea61cc56c1d8&show=true qTof LC-ESI Positive 3 0.00332642 0.810569 10.7593 12142 100 309.1635 Alesia Walker 0.3129 12142 8 O=C(O)C(N)CCCCNCC(=O)C(O)C(O)C(O)CO CCMSLIB00005720267 880.7178403 227.2005_5.943 227.2005 5.943 M+H Spectral Match to Myristoleic acid from NIST14 0.00149536 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 8012 993 Spectral Match to Myristoleic acid from NIST14 Isolated Data deposited by pmallard 3.146609408 1.580888167 4.601499431 4.601499431 3.46085872 2.709816642 1.762549939 2.781909249 1.901467764 2.648185857 3.46085872 3.46085872 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138383 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""8012.0"",""main.cluster index_upperinput"":""8012.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=993&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00149536 0.910743 6.58164 8012 105 227.2005 Data from Wolfender/Litaudon 5.943 8012 9 N/A CCMSLIB00003138383 302.8542252 318.1674_2.2699 318.1674 2.2699 M+H Spectral Match to Ile-Trp from NIST14 0.0136108 "PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.MIS2.FEC.V4R.TU017,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,TST.L007.FEC.V4R.TM006a,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,NO004,TM004,SM041,SM025,TU011,bftm2302,NO009,SM039,SM028,TU018,TU070,TM028,NO002,TU017,TU003,SM010,SM002,TU065,TU015,HCO09,NO011,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO020,GU017,TM024,TU016,TU041,TU073,GU001,TM003,GU004,TU066,NO012,GU016,TM023,TM001,HCO10,TM006a,TU072,NO010,NO003,TU068,TU069,SM023,TU067,GU002,TM026,HCO07,TM002,NO008,NO007,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,SM11.mzXML,NO11_NO2.mzXML,HCO69.mzXML,HCO07.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,HCO13.mzXML,HCO66.mzXML,SM39.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,HCO17.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM01.mzXML,16GU.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,HCO01.mzXML,SM33.mzXML,2GU.mzXML,HCO03.mzXML,NO10_NO2.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,23TM.mzXML,NO02_NO2.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,SM25,NO7,HCO41,26TM,HCO15,NO12,28TM,HCO14,3TM,HCO09,HCO63,4TM,GU2,SM23,HCO11,NO19,SM39,NO9,HCO01,31TM,24TM,NO1,TM23_02,17TM,HCO69,HCO10,NO13,NO4,11TM,HCO67,GU17,NO11,HCO17,NO3,NO8,NO5,NO10,GU16,HCO07,HCO65,HCO72,SM02,HCO13,HCO70,SM10,HCO68,HCO66,SM33" 0 29137 769 Spectral Match to Ile-Trp from NIST14 Isolated Data deposited by fevargas 0.008949218 0.195716679 0.439448752 0.439448752 0.304433732 0.222172655 0.22594315 0.077416796 0.24905751 0.102521574 0.304433732 0.304433732 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137880 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""29137.0"",""main.cluster index_upperinput"":""29137.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=769&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0.0136108 0.970158 42.777 29137 68 318.1674 Data from Christopher A. Lowry 2.2699 29137 12 N/A CCMSLIB00003137880 22.46337033 323.2734_6.8392 323.2734 6.8392 M-3H2O+H lithocholic acid 0.000396729 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.MIS2.FEC.V4R.TU063,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 36786 921 lithocholic acid commercial A. Jarmusch 1.708277033 5.060905151 3.167693293 3.167693293 5.427630377 3.5872807 5.049197621 2.177203883 5.040244804 2.349143728 5.427630377 5.427630377 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005435553 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""36786.0"",""main.cluster index_upperinput"":""36786.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=921&task=23bd059303474899a926ea61cc56c1d8&show=true Orbitrap ESI Positive 1 0.000396729 0.961845 1.22722 36786 102 323.2734 Dorrestein 6.8392 36786 14 C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C CCMSLIB00005435553 389.1217273 336.1923_3.2198 336.1923 3.2198 M+H-C11H12N2O3 Spectral Match to Leucine Enkephalin from NIST14 0.000305176 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 5849 268 Spectral Match to Leucine Enkephalin from NIST14 Isolated Data deposited by daniel 18.1299435 23.79187939 53.69565245 53.69565245 58.7809301 37.76140032 31.66098423 30.73989844 37.678535 35.36354859 58.7809301 58.7809301 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137728 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""5849.0"",""main.cluster index_upperinput"":""5849.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=268&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0.000305176 0.77535 0.907743 5849 105 336.1923 Data from Pieter Dorrestein 3.2198 5849 6 N/A CCMSLIB00003137728 4127.352544 338.3419_9.1869 338.3419 9.1869 M+H "Spectral Match to 13-Docosenamide, (Z)- from NIST14" 0.00012207 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 1394 1032 "Spectral Match to 13-Docosenamide, (Z)- from NIST14" Isolated Data deposited by pmallard 9.125239129 9.763144869 12.3279808 12.3279808 8.459152586 10.37894013 9.370322986 10.01999262 9.069929782 10.3480689 8.459152586 8.459152586 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136708 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""1394.0"",""main.cluster index_upperinput"":""1394.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1032&task=23bd059303474899a926ea61cc56c1d8&show=true HCD ESI Positive 3 0.00012207 0.820598 0.36079 1394 105 338.3419 Data from Wolfender/Litaudon 9.1869 1394 7 N/A CCMSLIB00003136708 1041.441826 352.1661_3.281 352.1661 3.281 M+H Spectral Match to Phe-Trp from NIST14 0.00012207 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 7486 769 Spectral Match to Phe-Trp from NIST14 Isolated Data deposited by fevargas 2.5760882 1.129152708 5.042454438 5.042454438 3.434724753 3.373387221 2.601645759 3.072823299 3.727669857 3.254959501 3.434724753 3.434724753 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003134979 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""7486.0"",""main.cluster index_upperinput"":""7486.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=769&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00012207 0.957285 0.346627 7486 104 352.1661 Data from Chris Turck 3.281 7486 10 N/A CCMSLIB00003134979 346.5394446 359.2661_0.5962 359.2661 0.5962 M+H Spectral Match to Ile-Val-Lys from NIST14 0.00189209 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 43446 257 Spectral Match to Ile-Val-Lys from NIST14 Isolated Data deposited by fevargas 11.55756384 21.20619917 56.07729192 56.07729192 45.37861329 43.45221002 30.86316141 39.17974759 38.24789724 49.30788163 45.37861329 45.37861329 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136608 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""43446.0"",""main.cluster index_upperinput"":""43446.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=257&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00189209 0.918088 5.26651 43446 104 359.2661 Data from Christopher A. Lowry 0.5962 43446 12 N/A CCMSLIB00003136608 4246.316203 199.169_5.3476 199.169 5.3476 M+H-H2O Spectral Match to 3-Hydroxydodecanoic acid from NIST14 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 9839 569 Spectral Match to 3-Hydroxydodecanoic acid from NIST14 Isolated Data deposited by mjmeehan 1.511756717 0.870578291 2.104281563 2.104281563 6.339428622 1.567498807 1.726692668 1.226584101 2.381368368 1.122020808 6.339428622 6.339428622 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137458 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""9839.0"",""main.cluster index_upperinput"":""9839.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=569&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0 0.956018 0 9839 104 199.169 Data from Gabriel Haddad 5.3476 9839 9 N/A CCMSLIB00003137458 249.8689484 369.3517_10.5045 369.3517 10.5045 M+H-H2O Spectral Match to Cholesterol from NIST14 0.000274658 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 9821 362 Spectral Match to Cholesterol from NIST14 Isolated Data deposited by mjmeehan 9.510851532 12.99468704 18.85489856 18.85489856 66.40247489 16.97479995 14.38516364 16.13343602 15.44846927 18.561717 66.40247489 66.40247489 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136045 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""9821.0"",""main.cluster index_upperinput"":""9821.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=362&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000274658 0.965694 0.743622 9821 105 369.3517 Data from Gabriel Haddad 10.5045 9821 19 N/A CCMSLIB00003136045 2589.948711 839.5646_5.1216 839.5646 5.1216 2M+Na Spectral Match to Cholic acid from NIST14 0.000549316 "PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,PMB.L007.FEC.V4R.SM034,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM039,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,PMB.L007.FEC.V4R.TM031,PMB.L007.FEC.V4R.TM002,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO019,PMB.L007.FEC.V4R.GU020,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU064,NO004,NO009,TU074,SM039,GU010,SM028,bftm2503,TU018,TU070,TM028,NO002,TU017,TU003,SM005,TU065,TU015,HCO09,NO011,GU006,TU061,NO019,SM011,TU004,NO001,bftm1702,bftm1301,NO020,GU012,NO006,TM024,TU016,GU019,GU001,GU004,TU066,NO012,bftm2901,SM030,TM023,SM034,TM001,HCO10,TU062,TU072,NO003,TU068,TM016,TU069,GU002,bftm0101,GU013,TM010,HCO07,TM002,NO008,GU020,bftm1104,SM033,TM031,NO005" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "BF17_02_BF3.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,1TM.mzXML,19GU.mzXML,HCO17.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,SM28.mzXML,HCO04.mzXML,16TM.mzXML,SM30.mzXML,HCO61.mzXML,NO20_NO2.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,HCO18.mzXML,28TM.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,12GU.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,2GU.mzXML,HCO03.mzXML,10GU.mzXML,HCO21.mzXML,HCO09.mzXML,23TM.mzXML,NO02_NO2.mzXML,SM05.mzXML,NO19_NO2.mzXML,HCO10.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,HCO61,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,HCO03,NO20,GU1,2TM,NO2,TM17_02,TM29_01,HCO15,NO12,28TM,HCO09,16TM,GU2,10TM,TM25_03,GU10,TM11_04,GU13,NO19,SM39,NO9,GU6,31TM,24TM,NO1,HCO69,HCO74,HCO10,TM01_01,TM13_01,GU20,NO4,SM05,NO11,HCO17,NO3,NO8,NO5,SM30,GU19,HCO07,HCO65,HCO72,HCO13,GU12,HCO70,HCO62,HCO68,HCO64,SM34,HCO66,SM33,NO6" 0 13930 -1 Spectral Match to Cholic acid from NIST14 Isolated Data deposited by fevargas 52.90762406 87.11539212 22.47694223 22.47694223 43.24892321 69.88280885 161.6851403 16.65590373 218.7090654 3.363606269 43.24892321 43.24892321 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003135030 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""13930.0"",""main.cluster index_upperinput"":""13930.0""}" This Node is a Singleton QqQ ESI Positive 3 0.000549316 0.984342 0.654288 13930 63 839.5646 Data from Joshua Wollam 5.1216 13930 4 N/A CCMSLIB00003135030 6671.557955 284.295_8.5526 284.295 8.5526 M+H Spectral Match to Octadecanamide from NIST14 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 30514 191 Spectral Match to Octadecanamide from NIST14 Isolated Data deposited by pmallard 9.094285524 11.26403658 8.062685916 8.062685916 7.14724478 9.207905771 9.862091601 9.145664797 8.790016026 9.164503864 7.14724478 7.14724478 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136793 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""30514.0"",""main.cluster index_upperinput"":""30514.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=191&task=23bd059303474899a926ea61cc56c1d8&show=true QqQ ESI Positive 3 0 0.766341 0 30514 105 284.295 Data from Wolfender/Litaudon 8.5526 30514 5 N/A CCMSLIB00003136793 928.4883854 405.2639_4.8148 405.2639 4.8148 M+H """""""(R)-4-((3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid""""""" 0.00012207 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 15837 1109 """""""(R)-4-((3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7,12-dioxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid""""""" crude Emily Gentry 3.308988858 19.21272477 124.7157949 124.7157949 7.312265217 34.06967304 13.80353908 5.271588716 9.667102963 5.991208663 7.312265217 7.312265217 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005464807 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""15837.0"",""main.cluster index_upperinput"":""15837.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=1109&task=23bd059303474899a926ea61cc56c1d8&show=true qTof ESI Positive 1 0.00012207 0.944584 0.301212 15837 105 405.2639 Dorrestein 4.8148 15837 19 C[C@@H]([C@H]1CC[C@]2([H])[C@]1(C)C(C[C@@]3([H])[C@@]2([H])C(C[C@@]4([H])[C@]3(C)CC[C@@H](O)C4)=O)=O)CCC(O)=O CCMSLIB00005464807 2757.314802 414.3009_5.0069 414.3009 5.0069 M-2H2O+H glycoursodeoxycholic acid 0.000915527 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,TM01_01,NO13,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 5312 651 glycoursodeoxycholic acid commercial A. Jarmusch 97.03012976 4.779833886 3.770362258 3.770362258 5.177972228 5.70700511 5.696661737 30.97166262 6.397765388 6.750224671 5.177972228 5.177972228 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00005435537 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""5312.0"",""main.cluster index_upperinput"":""5312.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=651&task=23bd059303474899a926ea61cc56c1d8&show=true Orbitrap ESI Positive 1 0.000915527 0.902995 2.20982 5312 103 414.3009 Dorrestein 5.0069 5312 12 C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C CCMSLIB00005435537 1594.267316 439.3585_7.6154 439.3585 7.6154 M+H-H2O Spectral Match to Oleanolic acid from NIST14 0.00149536 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,SM041,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,TM023,SM034,TM001,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 7031 502 Spectral Match to Oleanolic acid from NIST14 Isolated Data deposited by fevargas 16.40679393 26.42056189 1.836992537 1.836992537 30.26701356 10.8176453 23.2811547 6.702176948 20.88043155 3.143817386 30.26701356 30.26701356 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003138679 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""7031.0"",""main.cluster index_upperinput"":""7031.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=502&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00149536 0.89946 3.40352 7031 99 439.3585 Data from Suryasarathi Dasgupta 7.6154 7031 11 N/A CCMSLIB00003138679 1547.42202 466.3196_4.6924 466.3196 4.6924 M+H Spectral Match to Glycocholic acid from NIST14 0.00360107 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,NO013,NO005" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,GU6,31TM,24TM,NO1,18TM,TM23_02,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,HCO66,SM33,NO6" 0 5400 651 Spectral Match to Glycocholic acid from NIST14 Isolated Data deposited by fevargas 31.52526419 8.52197393 2.730055538 2.730055538 9.124114066 4.2224324 6.116970902 10.74372568 4.277850939 3.123828225 9.124114066 9.124114066 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003139073 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""5400.0"",""main.cluster index_upperinput"":""5400.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=651&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.00360107 0.961789 7.72239 5400 100 466.3196 Data from Joshua Wollam 4.6924 5400 24 N/A CCMSLIB00003139073 831.9168217 471.347_6.9183 471.347 6.9183 [M+H]+ Enoxolone 0 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 19417 -1 Enoxolone isolated MoNA:VF-NPL-QEHF013510 2.866462897 7.285823041 0.638519322 0.638519322 55.32791914 2.706983663 5.355115535 1.619318904 3.878692147 1.162032774 55.32791914 55.32791914 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00004704573 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""19417.0"",""main.cluster index_upperinput"":""19417.0""}" This Node is a Singleton ESI-QFT N/A positive 3 0 0.836699 0 19417 103 471.347 MoNA 6.9183 19417 17 N/A CCMSLIB00004704573 1233.164395 585.2723_8.8966 585.2723 8.8966 M+H Spectral Match to Bilirubin from METLIN 0.0032959 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,CNA.NOR.FEC.V4R.NO002,CNA.NOR.FEC.V4R.NO023,CNA.NOR.FEC.V4R.NO006,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,CNA.NOR.FEC.V4R.NO003,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.L007.FEC.V4R.TM024,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.TM027,CNA.NOR.FEC.V4R.NO011" "TU021,TM014,TM027,NO004,TU011,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,bftm2503,SM003,TU070,TM028,NO002,SM005,SM010,HCO09,NO011,GU006,TU061,TM017,NO019,TU004,NO021,NO001,NO022,TU012,NO020,GU012,NO006,GU017,bftm0902,TM024,GU019,GU004,NO012,bftm2901,GU016,TM023,TM001,TM006a,SM029,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,NO023,TM018,TM002,NO008,NO007,GU020,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,HCO74.mzXML,NO11_NO2.mzXML,HCO69.mzXML,BF29_01_BF3.mzXML,4GU.mzXML,31TM.mzXML,NO04_NO2.mzXML,20GU.mzXML,BF25_03_BF3.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,19GU.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,16GU.mzXML,HCO61.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,26TM.mzXML,NO13_NO2.mzXML,HCO12.mzXML,28TM.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,HCO09.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,HCO11.mzXML,NO19_NO2.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,HCO21,1TM,GU4,23TM,NO20,2TM,NO2,TM09_02,NO7,GU11,GU7,26TM,TM29_01,NO12,27TM,28TM,HCO14,NO22,HCO09,16TM,SM29,HCO12,GU2,SM23,TM25_03,GU10,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,TM01_01,NO13,GU20,NO4,HCO67,SM05,GU17,NO11,SM03,TM10_01,NO3,NO8,14TM,NO5,NO10,GU16,GU19,GU12,HCO70,SM10,HCO68,NO23,NO6" 0 28647 338 Spectral Match to Bilirubin from METLIN Isolated Data deposited by daniel 0.333124887 1.055474419 0.175910042 0.175910042 9.823062694 2.000747728 4.616995672 0.351140738 7.340511924 0.357746551 9.823062694 9.823062694 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003136956 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""28647.0"",""main.cluster index_upperinput"":""28647.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=338&task=23bd059303474899a926ea61cc56c1d8&show=true LC-ESI-QTOF LC-ESI Positive-40eV 3 0.0032959 0.921791 5.63143 28647 69 585.2723 Data from Pieter Dorrestein 8.8966 28647 5 N/A CCMSLIB00003136956 332.5363296 591.3181_4.0748 591.3181 4.0748 M+H Spectral Match to Urobilin from NIST14 0.00109863 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 9476 68 Spectral Match to Urobilin from NIST14 Isolated Data deposited by mjmeehan 91.1440178 223.2722071 269.3515276 269.3515276 5508.970877 192.3949545 294.0800312 60.79452097 348.2271908 49.66637213 5508.970877 5508.970877 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003137178 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""9476.0"",""main.cluster index_upperinput"":""9476.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=68&task=23bd059303474899a926ea61cc56c1d8&show=true HCD ESI Positive 3 0.00109863 0.963499 1.85794 9476 105 591.3181 Data from Gabriel Haddad 4.0748 9476 17 N/A CCMSLIB00003137178 114786.0765 595.3486_4.0491 595.3486 4.0491 M+H Stercobilin 0.00140381 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 28074 348 Stercobilin Other A. Jarmusch 4607.756944 5454.459986 3488.03784 3488.03784 9058.98196 5980.053258 5520.14373 6920.889187 5570.372475 7769.037676 9058.98196 9058.98196 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00001059689 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""28074.0"",""main.cluster index_upperinput"":""28074.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=348&task=23bd059303474899a926ea61cc56c1d8&show=true Orbitrap LC-ESI Positive 3 0.00140381 0.941756 2.35796 28074 105 595.3486 Dorrestein 4.0491 28074 20 CCC1C(C(=O)NC1CC2=NC(=CC3=C(C(=C(N3)CC4C(C(C(=O)N4)CC)C)C)CCC(=O)O)C(=C2C)CCC(=O)O)C CCMSLIB00001059689 668231.0493 177.1638_5.9084 177.1638 5.9084 M+H-H2O "Spectral Match to 2-Butanone, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)- from NIST14" 0.000198364 "bftm.0902.MURAZ,PMB.L007.FEC.V4R.GU007,PMB.L007.FEC.V4R.GU004,PMB.L007.FEC.V4R.GU001,CNA.NOR.FEC.V4R.NO002,PMB.L007.FEC.V4R.TM011,CNA.NOR.FEC.V4R.NO023,PMB.MIS2.FEC.V4R.TU062,CNA.NOR.FEC.V4R.NO006,PMB.MIS1.FEC.V4R.TU064,PMB.MIS1.FEC.V4R.TU065,PMB.L007.FEC.V4R.GU002,CNA.NOR.FEC.V4R.NO021,CNA.NOR.FEC.V4R.NO005,bftm.1301.MURAZ,CNA.NOR.FEC.V4R.NO012,PMB.L007.FEC.V4R.TM026,PMB.L007.FEC.V4R.SM025,PMB.MIS2.FEC.V4R.TU018,PMB.L007.FEC.V4R.GU006,bftm.2503.MURAZ,CNA.NOR.FEC.V4R.NO009,CNA.NOR.FEC.V4R.NO007,PMB.MIS2.FEC.V4R.TU011,PMB.L007.FEC.V4R.SM003,PMB.L007.FEC.V4R.SM034,PMB.L007.FEC.V4R.SM010,PMB.MIS2.FEC.V4R.TU013,PMB.MIS2.FEC.V4R.TU069,PMB.L007.FEC.V4R.TM001,PMB.MIS1.FEC.V4R.TU066,PMB.MIS2.FEC.V4R.TU016,CNA.NOR.FEC.V4R.NO003,bftm.2003.MURAZ,bftm.0101.MURAZ,PMB.L007.FEC.V4R.GU011,PMB.L007.FEC.V4R.GU010,CNA.NOR.FEC.V4R.NO001,PMB.MIS2.FEC.V4R.TU014,PMB.MIS1.FEC.V4R.TU001,bftm.1702.MURAZ,PMB.L007.FEC.V4R.SM041,bftm.2302.MURAZ,PMB.L007.FEC.V4R.TM016,PMB.MIS2.FEC.V4R.TU021,PMB.L007.FEC.V4R.SM002,PMB.L007.FEC.V4R.SM039,PMB.MIS2.FEC.V4R.TU067,PMB.L007.FEC.V4R.GU013,PMB.L007.FEC.V4R.TM004,PMB.MIS2.FEC.V4R.TU063,PMB.L007.FEC.V4R.SM005,PMB.MIS2.FEC.V4R.TU074,bftm.2203.MURAZ,PMB.MIS1.FEC.V4R.TU012,bftm.1001.MURAZ,PMB.L007.FEC.V4R.TM031,PMB.MIS2.FEC.V4R.TU073,PMB.L007.FEC.V4R.TM002,PMB.L007.FEC.V4R.SM029,PMB.MIS2.FEC.V4R.TU017,PMB.L007.FEC.V4R.SM030,PMB.MIS1.FEC.V4R.TU007,PMB.MIS2.FEC.V4R.TU053,PMB.MIS2.FEC.V4R.TU061,CNA.NOR.FEC.V4R.NO020,PMB.MIS2.FEC.V4R.TU068,PMB.L007.FEC.V4R.TM010,PMB.L007.FEC.V4R.TM014,TST.L007.FEC.V4R.TM006a,bftm.1104.MURAZ,PMB.L007.FEC.V4R.SM011,PMB.MIS1.FEC.V4R.TU003,PMB.L007.FEC.V4R.TM018,PMB.L007.FEC.V4R.GU016,PMB.L007.FEC.V4R.TM028,PMB.MIS1.FEC.V4R.TU009,PMB.MIS2.FEC.V4R.TU015,PMB.L007.FEC.V4R.SM023,PMB.MIS2.FEC.V4R.TU070,PMB.MIS1.FEC.V4R.TU004,PMB.L007.FEC.V4R.TM017,bftm.2901.MURAZ,CNA.NOR.FEC.V4R.NO022,PMB.L007.FEC.V4R.GU017,PMB.L007.FEC.V4R.TM003,PMB.L007.FEC.V4R.SM001,CNA.NOR.FEC.V4R.NO019,CNA.NOR.FEC.V4R.NO013,PMB.MIS2.FEC.V4R.TU041,PMB.L007.FEC.V4R.GU020,CNA.NOR.FEC.V4R.NO010,PMB.L007.FEC.V4R.TM023,PMB.L007.FEC.V4R.GU019,PMB.L007.FEC.V4R.SM033,CNA.NOR.FEC.V4R.NO004,PMB.L007.FEC.V4R.GU012,PMB.MIS1.FEC.V4R.TU010,PMB.L007.FEC.V4R.TM024,PMB.L007.FEC.V4R.SM028,CNA.NOR.FEC.V4R.NO008,PMB.L007.FEC.V4R.SM037,PMB.L007.FEC.V4R.TM027,PMB.MIS2.FEC.V4R.TU072,CNA.NOR.FEC.V4R.NO011" "TU013,TU021,TU063,TM014,TM027,TU064,NO004,TM004,SM041,SM025,TU011,SM037,GU007,bftm2302,NO009,TU074,GU011,TU053,SM039,GU010,SM028,bftm2503,SM003,TU018,TU070,TM028,NO002,TU017,TU003,SM005,SM010,bftm2203,SM002,TU065,TU015,HCO09,NO011,GU006,SM001,TU061,TM017,NO019,SM011,TU004,NO021,TM011,NO001,NO022,bftm1702,bftm1301,TU012,NO020,GU012,bftm2003,NO006,GU017,bftm0902,TM024,TU016,TU041,TU073,GU019,GU001,TM003,GU004,TU066,NO012,bftm2901,GU016,SM030,TM023,SM034,TM001,HCO10,TU062,TM006a,SM029,TU072,NO010,NO003,TU068,TM016,TU069,SM023,TU067,bftm1001,GU002,bftm0101,TM026,GU013,TM010,HCO07,NO023,TM018,TM002,NO008,NO007,GU020,bftm1104,SM033,TM031,TU014,NO013,NO005,TU001" "USA,BurkinaFaso,Peru" "Isolated Traditional (4),Rural Industrial (2),Urban Industrial (1),Rural Traditional (3)" "4,3,2,1" "NO23_NO2.mzXML,BF17_02_BF3.mzXML,11GU.mzXML,6GU.mzXML,13GU.mzXML,10TM.mzXML,NO03_NO2.mzXML,HCO70.mzXML,NO08_NO2.mzXML,7GU.mzXML,SM11.mzXML,HCO74.mzXML,NO11_NO2.mzXML,BF11_04_BF3.mzXML,SM34.mzXML,HCO69.mzXML,HCO07.mzXML,BF29_01_BF3.mzXML,HCO62.mzXML,4GU.mzXML,31TM.mzXML,HCO41.mzXML,SM41.mzXML,NO04_NO2.mzXML,20GU.mzXML,HCO13.mzXML,BF25_03_BF3.mzXML,HCO64.mzXML,HCO66.mzXML,SM39.mzXML,27TM.mzXML,1TM.mzXML,6TM.mzXML,11TM.mzXML,19GU.mzXML,HCO17.mzXML,HCO53.mzXML,BF23_02_BF3.mzXML,24TM.mzXML,2TM.mzXML,BF01_01_BF3.mzXML,HCO68.mzXML,NO09_NO2.mzXML,HCO67.mzXML,SM29.mzXML,SM28.mzXML,HCO63.mzXML,HCO04.mzXML,SM03.mzXML,16TM.mzXML,NO22_NO2.mzXML,SM01.mzXML,16GU.mzXML,SM30.mzXML,HCO61.mzXML,3TM.mzXML,NO21_NO2.mzXML,NO20_NO2.mzXML,17TM.mzXML,HCO16.mzXML,1GU.mzXML,HCO65.mzXML,26TM.mzXML,NO13_NO2.mzXML,BF20_03_BF3.mzXML,HCO12.mzXML,SM25.mzXML,HCO18.mzXML,28TM.mzXML,SM37.mzXML,NO05_NO2.mzXML,NO12_NO2.mzXML,SM23.mzXML,HCO15.mzXML,HCO72.mzXML,NO01_N02.mzXML,17GU.mzXML,12GU.mzXML,HCO01.mzXML,SM33.mzXML,BF13_01_BF3.mzXML,BF09_02_BF3.mzXML,2GU.mzXML,BF10_01_BF3.mzXML,14TM.mzXML,HCO03.mzXML,NO10_NO2.mzXML,10GU.mzXML,HCO21.mzXML,SM10.mzXML,HCO14.mzXML,SM02.mzXML,HCO09.mzXML,BF22_03_BF3.mzXML,23TM.mzXML,NO02_NO2.mzXML,18TM.mzXML,SM05.mzXML,4TM.mzXML,HCO11.mzXML,NO19_NO2.mzXML,HCO73.mzXML,HCO10.mzXML,NO07_NO2.mzXML,NO06_NO2.mzXML" "Norman,Guayabo,TamboDeMora,Matses,BurkinaFaso,Tunapuco" "HCO04,6TM,HCO53,HCO61,NO21,SM11,HCO21,HCO18,SM28,1TM,GU4,23TM,HCO16,SM41,HCO73,HCO03,SM01,NO20,GU1,2TM,NO2,TM09_02,TM17_02,SM25,NO7,HCO41,GU11,GU7,26TM,TM29_01,HCO15,NO12,SM37,27TM,28TM,HCO14,NO22,3TM,HCO09,HCO63,16TM,SM29,HCO12,4TM,GU2,SM23,10TM,TM25_03,GU10,TM11_04,HCO11,GU13,NO19,SM39,NO9,HCO01,GU6,31TM,24TM,NO1,18TM,TM23_02,17TM,HCO69,HCO74,HCO10,TM01_01,NO13,TM13_01,GU20,NO4,11TM,HCO67,SM05,TM20_03,GU17,NO11,SM03,HCO17,TM10_01,NO3,NO8,14TM,NO5,SM30,NO10,GU16,GU19,HCO07,HCO65,HCO72,SM02,HCO13,TM22_03,GU12,HCO70,HCO62,SM10,HCO68,HCO64,SM34,NO23,HCO66,SM33,NO6" 0 18093 247 "Spectral Match to 2-Butanone, 4-(2,6,6-trimethyl-2-cyclohexen-1-yl)- from NIST14" Isolated Data deposited by pmallard 1.667118338 0.652013147 0.398377632 0.398377632 3.174505885 0.758991311 0.99114991 0.973490291 1.250489788 0.719160007 3.174505885 3.174505885 http://gnps.ucsd.edu/ProteoSAFe/gnpslibraryspectrum.jsp?SpectrumID=CCMSLIB00003135312 "https://gnps.ucsd.edu/ProteoSAFe/result.jsp?task=23bd059303474899a926ea61cc56c1d8&view=view_all_clusters_withID&show=true#{""main.cluster index_lowerinput"":""18093.0"",""main.cluster index_upperinput"":""18093.0""}" https://gnps.ucsd.edu/ProteoSAFe/result.jsp?view=network_displayer&componentindex=247&task=23bd059303474899a926ea61cc56c1d8&show=true Q-TOF ESI Positive 3 0.000198364 0.898373 1.11966 18093 105 177.1638 Data from Wolfender/Litaudon 5.9084 18093 6 N/A CCMSLIB00003135312 133.1627473