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Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1-AMINOCYCLOPROPANECARBOXYLATE_11-Aminocyclopropanecarboxylic acidME565985----
1-AMINOCYCLOPROPANECARBOXYLATE_21-Aminocyclopropanecarboxylic acidME565987----
1-METHYLADENOSINE_peak21-MethyladenosineME566073----
1-Methylguanine_5.1971-MethylguanineME566049----
1-Methylguanine_6.1171-MethylguanineME566036----
1-METHYL-L-HISTIDINE1-MethylhistidineME565983----
1-Vinylimidazole_12.084-ME566035----
1-Vinylimidazole_12.472-ME566038----
2-Amino-3-methoxybenzoic acid_6.1183-Methoxyanthranilic acidME566025----
2-DEOXY-D-GLUCOSE2-Deoxy-glucoseME566034----
3-HYDROXYANTHRANILATE_peak13-Hydroxyanthranilic acidME566084----
3-METHYLADENINE3-MethyladenineME566061----
3-METHYL-L-HISTIDINE3-MethylhistidineME565988----
4-ACETAMIDOBUTANOATE_peak14-Acetamidobutanoic acidME566028----
4-ACETAMIDOBUTANOATE_peak24-Acetamidobutanoic acidME566080----
4-(allyloxy)-1,2-dihydroquinolin-2-one_2.846-ME566067----
4-AMINOBENZOATEp-Aminobenzoic acidME565971----
4-GUANIDINOBUTANOATE4-Guanidinobutanoic acidME566014----
4-Methyl-5-thiazoleethanol_13.1365-(2-Hydroxyethyl)-4-methylthiazoleME566018----
4-Methyl-5-thiazoleethanol_2.1055-(2-Hydroxyethyl)-4-methylthiazoleME566050----
4-QUINOLINECARBOXYLATE4-Quinolinecarboxylic acidME566040----
5-AMINOLEVULINATE5-Amino-levulinic acidME566009----
5'-DEOXYADENOSINE5'-DeoxyadenosineME566092----
5-HYDROXYINDOLEACETATE5-Hydroxyindoleacetic acidME566069----
6-Methoxyquinoline_7.136-MethoxyquinolineME565982----
6-Methylnicotinamide_7.666-ME565994----
Acadesine_5.615AICARME566011----
AcCa(3-0)-ME565986----
AcCa(4-0)-ME565989----
AcCa(5-0)-ME566017----
Acetohydroxamic acid_1.775Acetohydroxamic acidME565980----
Acetophenone_7.027AcetophenoneME565998----
ACETYLCHOLINEAcetylcholineME566004----
ADENINEAdenineME566020----
ALLANTOINAllantoinME566013----
AMINOADIPATEAminoadipic acidME566066----
AMINOISOBUTANOATE or GAMMA-AMINOBUTYRATE-ME566037----
ARGININEArginineME565934----
ASPARAGINEAsparagineME566005----
ASPARTATEAspartic acidME566031----
ASYMMETRIC or SYMMETRIC DIMETHYLARGININE-ME565979----
BETAINE or 5-AMINOPENTANOATE-ME565946----
BILIVERDINBiliverdinME566071----
BIOTIN_peak2BiotinME566010----
CARNOSINECarnosineME566033----
CHOLINECholineME565944----
CIS-TRANS-4-HYDROXY-D-L-PROLINE-ME565956----
CITRULLINECitrullineME566051----
CREATINECreatineME565959----
CREATININECreatinineME565949----
CYSTATHIONINECystathionineME566063----
CYSTEINECysteineME566087----
CYSTINECystineME565945----
CYTIDINE_8.261CytidineME566041----
CYTOSINE_peak1_1-ME566019----
CYTOSINE_peak1_2-ME566064----
DEOXYCYTIDINE_1DeoxycytidineME566022----
DEOXYCYTIDINE_2DeoxycytidineME566059----
DEOXYGUANOSINE or ADENOSIDE-ME566027----
DL-Stachydrine_6.358StachydrineME566045----
ERYTHRITOL or THREITOL-ME566095----
FOLATEFolic acidME566001----
GLUTAMATEGlutamic acidME565955----
GLUTAMINEGlutamineME565958----
GLUTATHIONE DISULFIDE (GSSG)Oxidized glutathioneME566094----
GLYCOCHENODEOXYCHOLATEGlycochenodeoxycholic acidME566030----
GLYCOCHOLATEGlycocholic acidME566060----
GUANIDINOSUCCINATEGuanidinosuccinic acidME566086----
GUANINEGuanineME565993----
GUANOSINEGuanosineME566075----
HEXITOLSorbitolME566003----
HIPPURATEHippuric acidME565978----
HISTIDINEHistidineME565943----
HOMOCYSTINEDL-HomocystineME566048----
HYPOXANTHINE_1HypoxanthineME565964----
HYPOXANTHINE_2HypoxanthineME566007----
INDOLE-3-ACETATEIndoleacetic acidME566006----
INDOLE-3-ETHANOLTryptophanolME566056----
INDOLEACETALDEHYDEIndoleacetaldehydeME566074----
INOSINEInosineME566093----
ISOLEUCINEIsoleucineME565931----
KYNURENATEKynurenic acidME566062----
KYNURENINEKynurenineME566023----
LACTOSE_7.126LactoseME566091----
L-ALANINEAlanineME565975----
L-CARNITINECarnitineME565942----
LEUCINELeucineME565933----
Leucylproline_5.796Leu-ProME565995----
L-ORNITHINEOrnithineME565963----
LPC(16-0)LPC 16:0ME565936----
LPC(16-1)LPC 16:1ME565966----
LPC(18-0)LPC 18:0ME565952----
LPC(18-1)LPC 18:1ME565961----
LPC(18-2)LPC 18:2ME565947----
LUMICHROMELumichromeME566077----
LYSINELysineME565940----
Maltol (peak 1)_3.357-ME566016----
Maltol (peak 2)_3.696-ME566008----
METHIONINE (misannotated as M+NH4)-ME565953----
METHIONINE SULFONEMethionine sulfoneME566072----
METHYL 4-AMINOBUTYRATEMethyl 4-aminobutanoateME565977----
Methylimidazoleacetic acid_6.411Methylimidazoleacetic acidME566026----
N'2-acetylpyridine-2-carbohydrazide_5.559-ME566047----
N-ACETYLASPARAGINEN-AcetylasparagineME566097----
N-ACETYLASPARTATEN-Acetylaspartic acidME566089----
N-ACETYLHEXOSAMINE_peak1N-AcetylhexosamineME566076----
N-ACETYLLEUCINEN-AcetylleucineME566088----
N-ACETYL-L-ORNITHINEN-AcetylornithineME566002----
N-ACETYLMETHIONINEN-AcetylmethionineME566083----
N-ACETYLPHENYLALANINEN-AcetylphenylalanineME566082----
N-ACETYLPROLINE_peak1N-Acetyl-prolineME566096----
N-ACETYLPROLINE_peak2N-Acetyl-prolineME566090----
N-ACETYLPUTRESCINEN-AcetylputrescineME566042----
N-ACETYLSERINEN-AcetylserineME566081----
N-ACETYLTRYPTOPHAN_peak1N-Acetyl-tryptophanME566079----
N-ALPHA-ACETYLLYSINEN(2)-AcetyllysineME566070----
N-Benzylformamide_1.719N-benzylformamideME566058----
N-Benzylformamide_7.026N-benzylformamideME565941----
NICOTINAMIDENiacinamideME565938----
NICOTINIC ACIDNicotinic acidME565969----
N-Methyl-2-pyrrolidone_2.044N-Methylpyrrolidin-2-oneME566032----
N-METYL-ALANINE or 2-AMINOISOBUTYRATE-ME566012----
N,N,N-TRIMETHYLLYSINEN-6-TrimethyllysineME566000----
Norepinephrine_7.54NorepinephrineME565957----
NP-013538_3.359-ME566015----
O-ACETYLCARNITINECAR 2:0ME565950----
Oxepanone_5.893-ME566085----
PANTOTHENATE_peak1Pantothenic acidME565951----
PC(34-1)PC 34:1ME566021----
PC(34-2)PC 34:2ME565962----
PC(36-2)PC 36:2ME565992----
PC(36-4)_1PC 36:4ME565967----
PC(36-4)_2PC 36:4ME565968----
PC(38-4)PC 38:4ME565997----
PC(38-6)PC 38:6ME565974----
PC(40-6)PC 40:6ME566039----
PC_834.59638_4.413-ME566054----
Penicillin G_1.607Penicillin GME565990----
Phenylacetylglycine_1.774PhenylacetylglycineME565984----
PHOSPHORYLCHOLINECholine phosphateME566078----
PIPECOLATEPipecolic acidME565981----
PROLINEProlineME565939----
PYRIDOXINEPyridoxineME565954----
PYROGLUTAMATE or OXOPROLINE-ME565932----
Quinoline_6.008QuinolineME566024----
RIBOFLAVINRiboflavinME565991----
SERINESerineME565999----
TAURINETaurineME566029----
ThiamineThiamineME565965----
THREONINE or HOMOSERINE (summed two peaks)-ME565973----
THYMINEThymineME566046----
TRYPTOPHANTryptophanME565948----
TYROSINETyrosineME565935----
URACILUracilME565976----
URATEUric acidME565960----
UREIDOPROPIONATEUreidopropionic acidME566043----
URIDINEUridineME566068----
VALINE or NORVALINE-ME565937----
XANTHINEXanthineME565972----


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