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Analysis: HILIC POSITIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
BenzylamineBenzylamineME267966---108.0808
HypotaurineHypotaurineME267967---110.027
HistamineHistamineME267968---112.0869
CreatinineCreatinineME267969---114.0662
ProlineProlineME267970---116.0706
AcetylglycineN-AcetylglycineME267971---118.0498
PhenylethylaminePhenylethylamineME267972---122.0964
Benzoic acidBenzoic acidME267973---123.044
TaurineTaurineME267974---126.022
3-Methylhistamine3-MethylhistamineME267975---126.1026
QuinolineQuinolineME267976---130.0652
N-AcetylputrescineN-AcetylputrescineME267977---131.118
OrnithineOrnithineME267978---133.0971
HomocysteineHomocysteineME267979---136.0427
HypoxanthineHypoxanthineME267980---137.0458
GlutamineGlutamineME267981---147.0764
LysineLysineME267982---147.1128
Glutamic acidGlutamic acidME267983---148.0604
MethionineMethionineME267984---150.0584
GuanineGuanineME267985---152.0567
24-Dihydroxyacetophenone2',4'-DihydroxyacetophenoneME267986---153.0546
3-Sulfinoalanine3-Sulfino-alanineME267987---154.0169
p-OctopamineOctopamineME267988---154.0862
HistidineHistidineME267989---156.0768
AllantoinAllantoinME267990---159.0512
IndoleacetaldehydeIndoleacetaldehydeME267991---160.0757
Phenylpyruvic acidPhenylpyruvic acidME267992---165.0547
PhenylalaninePhenylalanineME267993---166.0863
PyridoxalPyridoxalME267994---168.0656
Uric acidUric acidME267995---169.0356
1-Methylhistidine1-MethylhistidineME267996---170.0923
Quinaldic acidQuinaldic acidME267997---174.055
Guanidinosuccinic acidGuanidinosuccinic acidME267998---176.0663
Indoleacetic acidIndoleacetic acidME267999---176.0707
CitrullineCitrullineME268000---176.103
Hippuric acidHippuric acidME268001---180.0655
GlucosamineGlucosamineME268002---180.0866
(R)-Salsolinol(R)-SalsolinolME268003---180.1019
TyrosineTyrosineME268004---182.0812
4-Pyridoxic acid4-Pyridoxic acidME268005---184.0605
Indole-3-methyl acetateIndole-3-methyl acetateME268006---190.0863
trans-Ferulic acidtrans-Ferulic acidME268007---195.0652
TryptophanTryptophanME268008---205.0972
LipoamideLipoamideME268009---206.0669
N-Acetyl-L-phenylalanineN-AcetylphenylalanineME268010---208.0972
KynurenineKynurenineME268011---209.092
DethiobiotinDethiobiotinME268012---215.1392
12-Hydroxydodecanoic acid12-Hydroxy lauric acidME268013---217.1798
Pantothenic acidPantothenic acidME268014---220.1179
5-Hydroxy-L-tryptophan5-Hydroxy-tryptophanME268015---221.0921
Methyl jasmonateMethyl jasmonateME268016---225.1485
UridineUridineME268017---245.0766
InosineInosineME268018---269.0881
All-trans-retinoic acidRetinoic acidME268019---301.2162
SphinganineSphinganineME268020---302.3054
N-Acetylneuraminic acidN-Acetylneuraminic acidME268021---310.1125
DodecanoylcarnitineCAR 12:0ME268022---344.2797
CortisolCortisolME268023---363.2165
S-AdenosylhomocysteineS-AdenosylhomocysteineME268024---385.1281
Cholic acidCholic acidME268025---409.2966
BiliverdinBiliverdinME268026---583.2543
BilirubinBilirubinME268027---585.2706


Analysis: Reversed phase NEGATIVE ION MODE (View original submitter results)

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
SerineSerineME268028---104.0352
Glyceric acidGlyceric acidME268029---105.0193
CreatinineCreatinineME268030---112.0516
Mesoxalic acidMesoxalic acidME268031---116.983
4-Hydroxybenzaldehyde4-HydroxybenzaldehydeME268032---121.0295
Ureidopropionic acidUreidopropionic acidME268033---131.0462
Aspartic acidAspartic acidME268034---132.0302
HypoxanthineHypoxanthineME268035---135.0302
Phenylacetic acidPhenylacetic acidME268036---135.0452
SalicylamideSalicylamideME268037---136.0404
Caprylic acidCaprylic acidME268038---143.1078
Oxoglutaric acid2-Oxoglutaric acidME268039---145.0143
GlutamineGlutamineME268040---145.0619
trans-Cinnamic acidtrans-Cinnamic acidME268041---147.0452
MethionineMethionineME268042---148.0439
XanthineXanthineME268043---151.0262
HistidineHistidineME268044---154.0623
Pelargonic acidPelargonic acidME268045---157.1234
IndoleacetaldehydeIndoleacetaldehydeME268046---158.0612
Aminoadipic acidAminoadipic acidME268047---160.0616
PhenylalaninePhenylalanineME268048---164.0717
3-(2-Hydroxyphenyl)propanoic acid3-(2-Hydroxyphenyl)propanoic acidME268049---165.0557
Uric acidUric acidME268050---167.0211
N-AcetylasparagineN-AcetylasparagineME268051---173.0569
Suberic acidSuberic acidME268052---173.082
N-Acetyl-L-aspartic acidN-Acetylaspartic acidME268053---174.0407
Indoleacetic acidIndoleacetic acidME268054---174.0561
CitrullineCitrullineME268055---174.0885
Hippuric acidHippuric acidME268056---178.0511
TyrosineTyrosineME268057---180.0667
N-Acetylglutamic acidN-Acetylglutamic acidME268058---188.0565
5-Hydroxyindoleacetic acid5-Hydroxyindoleacetic acidME268059---190.051
Quinic acidQuinic acidME268060---191.0562
12-Hydroxydodecanoic acid12-Hydroxy lauric acidME268061---215.1652
Pantothenic acidPantothenic acidME268062---218.1031
Myristic acidMyristic acidME268063---227.2016
Ribose 5-phosphateRibose 5-phosphateME268064---229.0121
CystineCystineME268065---239.0162
UridineUridineME268066---243.0621
Palmitoleic acidPalmitoleic acidME268067---253.2172
Palmitic acidPalmitic acidME268068---255.2328
Heptadecanoic acidMargaric acidME268069---269.2484
Gamma-Linolenic acidgamma-Linolenic acidME268070---277.2173
Linoleic acidLinoleic acidME268071---279.2329
Stearic acidStearic acidME268072---283.2641
All-trans-retinoic acidRetinoic acidME268073---299.2012
N-Acetylneuraminic acidN-Acetylneuraminic acidME268074---308.098
Arachidic acidArachidic acidME268075---311.2956
Docosahexaenoic acidDocosahexaenoic acidME268076---327.2328
Leukotriene B4LTB4ME268077---335.2229
Cholic acidCholic acidME268078---407.2796
Glycocholic acidGlycocholic acidME268079---464.3016
BiliverdinBiliverdinME268080---581.2402
ThyroxineThyroxineME268081---775.6824


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