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Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
L-CitrullineCitrullineME516768--0.94176.2
L-ProlineProlineME516769--1116
L-GlutamateGlutamic acidME516770--0.9148
L-Aspartic acidAspartic acidME516771--1.05134.11
DeoxycytidineDeoxycytidineME516772--1.5228
CytidineCytidineME516773--1.3244
HistamineHistamineME516774--1112
L-ArginineArginineME516775--0.96175.21
L-LysineLysineME516776--0.8147.2
ThymineThymineME516777--2.92127.12
5-aminosalicylic acid-ME516778--1.54154.15
Adenosine 5'-monophosphateAMPME516779--1.51348.07
CytosineCytosineME516780--1.5112
TryptophanTryptophanME516781--5.71205.1
AdenineAdenineME516782--1.5136
L-OrnithineOrnithineME516783--0.78133.1
Phenyllactic acidPhenyllactic acidME516784--8.44165.05
L-AsparagineAsparagineME516785--0.95133.06
N-Acetyl-L-methionineN-AcetylmethionineME516786--6.197192.26
L-HistidineHistidineME516787--0.84156.16
L-MethionineMethionineME516788--1.5150
2-DeoxyguanosineDeoxyguanosineME516789--3.75268.27
N-Acetyl-L-cysteineN-AcetylcysteineME516790--3.38164.2
L-HomocysteineHomocysteineME516791--1.11136.05
Inosine-5'-monophosphateIMPME516792--1.57349.06
BetaineBetaineME516793--0.95118.16
PutrescinePutrescineME516794--0.7689.08
3-Guanidinopropionic acid 3-Guanidinopropanoic acidME516795--1.24132.14
2'-Deoxycytidine 5'-monophosphatedCMPME516796--1.48308.07
S-(5'-Adenosyl)-L-homocysteineS-AdenosylhomocysteineME516797--2.72385.1
SpermidineSpermidineME516798--0.71146.17
InosineInosineME516799--3.25269.09
AgmatineAgmatineME516800--0.88131.1
UracilUracilME516801--1.51113.1
2-hydroxy-2-phenylpropanoic acid-ME516802--8.3165.05
Aminoadipic acidAminoadipic acidME516803--1.07162.08
L-GlutamineGlutamineME516804--0.88147.08


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
Methylmalonic acidMethylmalonic acidME516805--2.74117.02
N-Acetylglutamic acidN-Acetylglutamic acidME516806--1.88-
TaurineTaurineME516807--0.9126
Succinic acidSuccinic acidME516808--2.31117.02
Maleic acidMaleic acidME516809--1.1133


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