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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-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholinePC 16:1(9Z)/0:0ME805979----
(.+/-.)-1-Amino-2-propanol-ME805973----
1-carbapenem-3-carboxylic acid-ME805980----
1-METHYLADENOSINE1-MethyladenosineME805982----
1-Methylguanine1-MethylguanineME805983----
1-METHYL-L-HISTIDINE1-MethylhistidineME805981----
1-(sn-glycero-3-phospho)-1D-myo-inositolsn-Glycero-3-phosphoinositolME805978----
"2,4-Diacetamido-2,4,6-trideoxy-alpha-D-mannopyran...-ME805984----
2-formylphenylformamide-ME805985----
2-Hydroxycinnamic acidtrans-o-Coumaric acidME805986----
(2R)-3-{[(2-Aminoethoxy)(hydroxy)phosphoryl]oxy}-2...-ME805974----
"(2S,3Z,5S)-3-(2-Aminoethylidene)-7-oxo-4-oxa-1-az...-ME805975----
3-Buten-1-amine3-Buten-1-amineME805987----
3-Methylinosine-ME805989----
3-METHYL-L-HISTIDINE3-MethylhistidineME805988----
3-phosphoglycerate3-Phosphoglyceric acidME805990----
3-ureidopropionateUreidopropionic acidME805991----
4-GUANIDINOBUTANOATE4-Guanidinobutanoic acidME805993----
4-Hydroxybenzaldehyde4-HydroxybenzaldehydeME805994----
4-Methyleneglutamine4-Methylene-glutamineME805995----
4-(Methylthio)-2-oxobutyric acid-ME805992----
4-PYRIDOXATE4-Pyridoxic acidME805996----
"5,10-CH2-H4PteGlu"-ME805997----
7-Methylguanosine7-MethylguanosineME805998----
AcetylarginineN-AcetylarginineME806000----
acetylcarnitineCAR 2:0ME806001----
Acetyl CoAAcetyl-CoAME805999----
ADENOSINE DIPHOSPHATE RIBOSEADP-riboseME806002----
afegostat-ME806003----
Ala-LeuAla-LeuME806004----
Ala-Leu (2)Ala-LeuME806005----
alanineAlanineME806006----
allysineAllysineME806007----
AMPAMPME806008----
AMP degenerate-ME806009----
argininosuccinateArgininosuccinic acidME806010----
asparagineAsparagineME806011----
AspartameAspartameME806012----
aspartateAspartic acidME806013----
Benzoxazolone2-BenzoxazololME806014----
beta-alaninebeta-AlanineME806015----
betaineBetaineME806016----
ButyrylcarnitineCAR 4:0ME806017----
BZ7175000-ME806018----
C5 Carnitines-ME806019----
carnitineCarnitineME806020----
CDP-ETHANOLAMINECDP-EthanolamineME806021----
CholineCholineME806022----
citrateCitric acidME806023----
citrullineCitrullineME806024----
CMPCMPME806025----
Coenzyme ACoenzyme AME806026----
coformycinCoformycinME806027----
CoumarinCoumarinME806028----
Coumarone-ME806029----
creatineCreatineME806030----
creatinineCreatinineME806031----
Creatinine degenerate-ME806032----
cystathionineCystathionineME806033----
Cysteine-glutathione disulfideS-Glutathionyl-cysteineME806034----
cystineCystineME806035----
cytidineCytidineME806036----
cytosineCytosineME806037----
dCytidineDeoxycytidineME806038----
DehydrocycloguanandinDehydrocycloguanandinME806039----
DehydroglycineDehydroglycineME806040----
delta-guanidinovaleric acidDGVAME806041----
DEOXYCARNITINE3-DehydroxycarnitineME806042----
DEOXYCARNITINE degenerate-ME806043----
dihydroanticapsin-ME806044----
dimethylformamide-ME806045----
dimethylglicineDimethylglycineME806046----
"DL-2,6-Diaminopimelic acid"-ME806047----
DL-StachydrineStachydrineME806048----
epsilon-(gamma-Glutamyl)-lysine (RT = 10.667)-ME806049----
epsilon-(gamma-Glutamyl)-lysine (RT = 11.658)-ME806050----
FADFADME806051----
fagomineFagomineME806052----
Formiminoglutamic AcidFormiminoglutamic acidME806053----
"Fructose 1,6-bisphosphate"Fructose 1,6-bisphosphateME806054----
fructose 6-phosphate/galactose-1-phosphate-ME806055----
FructoselysineFructosyllysineME806056----
gamma-Glu-glngamma-GlutamylglutamineME806057----
GDPGDPME806058----
Glucose 6-phosphateGlucose 6-phosphateME806059----
glutamateGlutamic acidME806060----
glutamineGlutamineME806061----
Glycerol 3-Phosphatesn-Glycero-3-phosphateME806062----
Glycerophosphocholinesn-Glycero-3-phosphocholineME806063----
glycineGlycineME806064----
GMPGMPME806065----
GNK-ME806066----
Golotimod-ME806067----
GSHGlutathioneME806068----
GSSGOxidized glutathioneME806069----
guanidinoacetateGuanidoacetic acidME806070----
GUANIDINOSUCCINATEGuanidinosuccinic acidME806071----
guanineGuanineME806072----
guanine degenerate-ME806073----
guanosineGuanosineME806074----
GUANOSINE DIPHOSPHATE MANNOSEGDP-mannoseME806075----
HC blue 2-ME806076----
HeterodendrinHeterodendrinME806077----
histidineHistidineME806078----
histidine (tail)-ME806079----
homocitrullineHomocitrullineME806081----
homocitrulline (tail)-ME806082----
Homo-L-arginineHomoarginineME806080----
hypoxanthineHypoxanthineME806083----
hypoxanthine (tail)-ME806084----
Imidazoleacetic acid ribosideImidazoleacetic acid ribosideME806085----
IMPIMPME806086----
inosineInosineME806087----
isoleucineIsoleucineME806088----
kynurenineKynurenineME806089----
lentiginosineLentiginosineME806090----
leucineLeucineME806091----
lysineLysineME806092----
Lysine lactam-ME806093----
methionineMethionineME806094----
methionine-13C5-15NMethionineME806096----
Methionine sulfoxideMethionine sulfoxideME806095----
MFCD00036904-ME806097----
MFCD00135289-ME806098----
MuscimolMuscimolME806099----
MW_102.04705@RT_4.869-ME806100----
MW_103.04568@RT_6.284-ME806101----
MW_119.07362@RT_4.865-ME806102----
MW_141.93145@RT_12.240-ME806103----
MW_168.05122@RT_9.206-ME806104----
MW_174.13701@RT_11.699-ME806105----
MW_184.04857@RT_2.279-ME806106----
MW_190.13186@RT_12.889-ME806107----
MW_192.14765@RT_5.742-ME806108----
MW_202.04554@RT_10.888-ME806109----
MW_202.04557@RT_8.570-ME806110----
MW_202.04557@RT_8.570 (2)-ME806111----
MW_203.12715@RT_9.480-ME806112----
MW_204.06103@RT_8.342-ME806113----
MW_214.00900@RT_12.421-ME806114----
MW_216.06114@RT_6.638-ME806115----
MW_218.16307@RT_5.460-ME806116----
MW_220.14238@RT_11.770-ME806117----
MW_230.09040@RT_10.434-ME806118----
MW_234.08527@RT_10.478-ME806119----
MW_234.15798@RT_5.951-ME806120----
MW_245.17390@RT_13.879-ME806121----
MW_248.10026@RT_9.781-ME806122----
MW_248.13723@RT_10.001-ME806123----
MW_249.03075@RT_12.337-ME806124----
MW_255.02291@RT_12.423-ME806125----
MW_259.16439@RT_13.838-ME806126----
MW_260.13721@RT_6.892-ME806127----
MW_273.03346@RT_12.439-ME806128----
MW_275.13687@RT_8.237-ME806129----
MW_285.09603@RT_3.493-ME806130----
MW_296.04943@RT_12.425-ME806131----
MW_297.18000@RT_12.509-ME806132----
MW_301.11732@RT_5.003-ME806133----
MW_303.15422@RT_11.640-ME806134----
MW_309.10593@RT_8.703-ME806135----
MW_311.96380@RT_12.332-ME806136----
MW_318.10622@RT_11.197-ME806137----
MW_321.06957@RT_13.811-ME806138----
MW_324.15331@RT_13.690-ME806139----
MW_350.15117@RT_8.553-ME806140----
MW_357.19331@RT_14.070-ME806141----
MW_368.24245@RT_12.683-ME806142----
MW_368.34420@RT_1.924-ME806143----
MW_374.10730@RT_11.416-ME806144----
MW_377.13226@RT_7.361-ME806145----
MW_385.19950@RT_14.698-ME806146----
MW_404.15447@RT_11.236-ME806147----
MW_406.02362@RT_12.452-ME806148----
MW_420.30988@RT_1.761-ME806149----
MW_421.21755@RT_10.392-ME806150----
MW_449.13409@RT_4.634-ME806151----
MW_453.12750@RT_4.804-ME806152----
MW_467.30117@RT_1.989-ME806153----
MW_486.17144@RT_6.476-ME806154----
MW_519.33305@RT_1.876-ME806155----
MW_523.36435@RT_1.856-ME806156----
MW_543.33299@RT_1.865-ME806157----
MW_567.33266@RT_1.833-ME806158----
MW_626.52723@RT_1.655-ME806159----
MW_700.55045@RT_1.778-ME806160----
MW_705.53067@RT_1.745-ME806161----
MW_729.53081@RT_1.720-ME806162----
MW_805.56206@RT_1.712-ME806163----
MW_829.56161@RT_1.704-ME806164----
MW_83.03722@RT_9.319-ME806165----
MW_83.03722@RT_9.319 (2)-ME806166----
MW_903.58360@RT_1.653-ME806167----
N~2~-Acetyl-L-ornithineN-AcetylornithineME806183----
N6-METHYLLYSINEN(6)-MethyllysineME806176----
N-ACETYLASPARAGINEN-AcetylasparagineME806171----
N-acetylglutamineN-AcetylglutamineME806172----
N-acetyllysineN(2)-AcetyllysineME806173----
NAD+NADME806177----
N-ALPHA-ACETYLLYSINEN(2)-AcetyllysineME806174----
N-BenzylformamideN-benzylformamideME806175----
niacinamideNiacinamideME806178----
Nitrosoguvacoline-ME806179----
"N,N-DIMETHYLARGININE"DimethylarginineME806169----
"N,N-dimethylarginine degenerate"-ME806170----
"N,N,N-TRIMETHYLLYSINE"N-6-TrimethyllysineME806168----
NP-001346-ME806180----
NPYR-ME806181----
NudifloramideN1-Methyl-2-pyridone-5-carboxamideME806182----
O-PHOSPHOETHANOLAMINEPhosphoethanolamineME806184----
OPHTHALMATEOphthalmic acidME806185----
ornithineOrnithineME806186----
Palmitoyl sphingomyelinSM 18:1;O2/16:0ME806188----
p-aminobenzoatep-Aminobenzoic acidME806187----
PANTOTHENATEPantothenic acidME806189----
PC-ME806190----
PergolidePergolideME806191----
phenylalaninePhenylalanineME806192----
phosphocholineCholine phosphateME806193----
phosphoenolpyruvatePhosphoenolpyruvic acidME806194----
PipecolatePipecolic acidME806195----
Pipecolinic acid degenerate-ME806196----
PiperidinePiperidineME806197----
PiracetamPiracetamME806198----
PirbuterolPirbuterolME806199----
PregabalinPregabalinME806200----
Pro-Hyp-ME806201----
Prolinamide-ME806202----
prolineProlineME806203----
Proline degenerate-ME806204----
Proline degenerate (2)-ME806205----
ProlylglycinePro-GlyME806206----
ProlylleucinePro-LeuME806207----
propionylcarnitineCAR 3:0ME806208----
Pyroglutamic AcidPyroglutamic acidME806209----
RiboflavinRiboflavinME806210----
Ribose-1/5-phosphate-ME806211----
saccharopineSaccharopineME806214----
(S)-ACPA (tail) (RT = 2.367)-ME805976----
(S)-ACPA (tail) (RT = 2.965)-ME805977----
S-Adenosyl-L-HomocysteineS-AdenosylhomocysteineME806212----
S-Adenosyl-L-methionineS-AdenosylmethionineME806213----
sarcosineSarcosineME806215----
serineSerineME806216----
sorbitolSorbitolME806217----
streptidineStreptidineME806218----
SuccinyladenosineSuccinyladenosineME806219----
taurineTaurineME806220----
ThiamineThiamineME806221----
THIAMINE MONOPHOSPHATEThiamine monophosphateME806222----
threonineThreonineME806223----
THTCTetrahydrothiophene-2-carboxylic acidME806224----
ThymineThymineME806225----
Tilarginine-ME806226----
trans-3-Indoleacrylic acidtrans-3-Indoleacrylic acidME806227----
tryptophanTryptophanME806228----
tyrosineTyrosineME806229----
UDP-GlcNAc/UDP-GalNAc-ME806230----
UMPUMPME806231----
uracilUracilME806232----
Uracil degenerate-ME806233----
uridineUridineME806234----
URIDINE DIPHOSPHATE GLUCURONIC ACIDUDP-glucuronic acidME806235----
valineValineME806236----
vinylglycine-ME806237----
xanthineXanthineME806238----
XANTHOSINEXanthosineME806239----
YV8195000-ME806240----


Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
(10S)-Juvenile hormone III diol-ME806241----
16-Oxohexadecanoic acid-ME806246----
1-Palmitoyl lysophosphatidic acid-ME806244----
1-(sn-glycero-3-phospho)-1D-myo-inositolsn-Glycero-3-phosphoinositolME806243----
1-Stearoyl-2-hydroxy-sn-glycero-3-PELPE 18:0/0:0ME806245----
2-aminobutyric_acid2-Aminobutyric acidME806247----
2-Furoic acid2-Furoic acidME806248----
2-hydroxybutyric_acid2-Hydroxybutyric acidME806249----
(2S)-2-Hydroxytetradecanoic acid-ME806242----
3-hydroxybutyric_acid/3-hydroxyisobutyric_acid-ME806250----
3-HYDROXYMETHYLGLUTARATE3-Hydroxymethylglutaric acidME806251----
3-methyl-2-oxopentanoic_acid3-Methyl-2-oxovaleric acidME806252----
3-OH-VPA-ME806253----
3-ureidopropionateUreidopropionic acidME806254----
4-phenolsulfonic acid-ME806255----
4-PYRIDOXATE4-Pyridoxic acidME806256----
4-tert-Octylphenol monoethoxylate-ME806257----
6-phosphogluconate6-Phosphogluconic acidME806258----
acetylalanineN-AcetylalanineME806259----
acetylaspartateN-Acetylaspartic acidME806260----
AcetylcarnitineCAR 2:0ME806261----
acetylglutamateN-Acetylglutamic acidME806262----
acetylserineO-AcetylserineME806263----
ADP-riboseADP-riboseME806264----
afegostat-ME806265----
alanineAlanineME806266----
amidoadipate-ME806267----
AMPAMPME806268----
Arachidonic acidArachidonic acidME806269----
arginineArginineME806270----
ascorbic acid 2-sulfate-ME806271----
asparagineAsparagineME806272----
AspartameAspartameME806273----
aspartateAspartic acidME806274----
BETAINEBetaineME806275----
carnitineCarnitineME806276----
Cholesterol sulfateCholesterol sulfateME806277----
Cholic acidCholic acidME806278----
CIS-4-HYDROXY-D-PROLINEcis-4-Hydroxy-D-prolineME806279----
citrate/iso-citrateCitric acid/Isocitric acidME806280----
citrullineCitrullineME806281----
CMPCMPME806282----
CorticosteroneCorticosteroneME806283----
creatineCreatineME806284----
creatinineCreatinineME806285----
Cysteine-glutathione disulfideS-Glutathionyl-cysteineME806286----
cytidineCytidineME806287----
dCytidineDeoxycytidineME806288----
epsilon-(gamma-Glutamyl)-lysine (RT = 10.667)-ME806289----
ErythroseErythroseME806290----
Ethopabate-ME806291----
"Fructose 1,6-bisphosphate"Fructose 1,6-bisphosphateME806292----
FRUCTOSE 6-PHOSPHATE/glucose-1-phosphateHexose 6-phosphateME806293----
FucoseFucoseME806294----
fumarateFumaric acidME806295----
GALACTURONATEGalacturonic acidME806296----
gamma-Glu-glngamma-GlutamylglutamineME806297----
GDPGDPME806298----
GLUCONATEGluconic acidME806299----
GLUCOSAMINE 6-PHOSPHATEGlucosamine 6-phosphateME806300----
glucoseGlucoseME806301----
Glucose 6-phosphate/GALACTOSE-1-PHOSPHATE-ME806302----
GLUCURONATEGlucuronic acidME806303----
glutamateGlutamic acidME806304----
glutamineGlutamineME806305----
Glycerol 3-Phosphatesn-Glycero-3-phosphateME806306----
Glycerophosphocholinesn-Glycero-3-phosphocholineME806307----
GSHGlutathioneME806308----
GSSGOxidized glutathioneME806309----
guanosineGuanosineME806310----
GUANOSINE DIPHOSPHATE MANNOSEGDP-mannoseME806311----
histidineHistidineME806312----
Homo-L-arginineHomoarginineME806313----
Homovanillic acidHomovanillic acidME806314----
hydroxyacetone phosphateHydroxyacetone phosphateME806315----
hydroxyproline/5-aminolevulinic acid-ME806316----
hypoxanthineHypoxanthineME806317----
indolelactateIndolelactic acidME806318----
INDOXYL SULFATEIndoxyl sulfateME806319----
inosineInosineME806320----
Isethionic acid2-HydroxyethanesulfonateME806321----
Isethionic acid (2)2-HydroxyethanesulfonateME806322----
isoleucineIsoleucineME806323----
isoleucine/leucineLeucine/IsoleucineME806324----
Juniperic acidJuniperic acidME806325----
lactic_acidLactic acidME806326----
Linoleic acidLinoleic acidME806327----
lysineLysineME806328----
LYXOSELyxoseME806329----
malateD-Malic acidME806330----
MELIBIOSE/TREHALOSE-ME806331----
methionineMethionineME806332----
Methionine sulfoxideMethionine sulfoxideME806333----
METHYL GALACTOSIDEMethyl beta-D-galactosideME806334----
MFCD12546417-ME806335----
MW_167.02491@RT_4.922-ME806336----
MW_175.94433@RT_12.248-ME806337----
MW_184.04857@RT_2.279-ME806338----
MW_202.02961@RT_2.007-ME806339----
MW_216.03964@RT_8.684-ME806340----
MW_216.03964@RT_8.684 (tail)-ME806341----
MW_217.91624@RT_12.235-ME806342----
MW_224.08912@RT_6.649-ME806343----
MW_224.17717@RT_1.837-ME806344----
MW_228.00319@RT_8.794-ME806345----
MW_228.00319@RT_8.794 (2)-ME806346----
MW_231.11079@RT_6.874-ME806347----
MW_234.08527@RT_10.478-ME806348----
MW_240.17217@RT_1.850-ME806349----
MW_242.18769@RT_1.876-ME806350----
MW_245.05797@RT_5.488-ME806351----
MW_248.10026@RT_9.781-ME806352----
MW_260.13721@RT_6.892-ME806353----
MW_261.05277@RT_6.228-ME806354----
MW_283.21457@RT_1.909-ME806355----
MW_294.08461@RT_2.769-ME806356----
MW_296.00026@RT_12.402-ME806357----
MW_303.05874@RT_13.814-ME806358----
MW_303.97320@RT_12.217-ME806359----
MW_305.98890@RT_12.146-ME806360----
MW_309.10593@RT_8.703-ME806361----
MW_319.02183@RT_10.792-ME806362----
MW_320.07046@RT_14.104-ME806363----
MW_321.06957@RT_13.811-ME806364----
MW_324.15331@RT_13.690-ME806365----
MW_330.25545@RT_1.725-ME806366----
MW_332.27121@RT_1.719-ME806367----
MW_337.86569@RT_12.243-ME806368----
MW_344.19851@RT_1.985-ME806369----
MW_349.03247@RT_10.874-ME806370----
MW_372.98140@RT_12.400-ME806371----
MW_373.97772@RT_12.399-ME806372----
MW_375.25189@RT_1.761-ME806373----
MW_422.23357@RT_1.714-ME806374----
MW_436.25860@RT_1.905-ME806375----
MW_450.95852@RT_12.428-ME806376----
MW_466.10637@RT_4.823-ME806377----
MW_473.09572@RT_4.840-ME806378----
MW_515.29078@RT_2.108-ME806379----
MW_555.31773@RT_1.956-ME806380----
MW_557.33318@RT_1.931-ME806381----
MW_581.33297@RT_1.892-ME806382----
MW_585.36445@RT_1.872-ME806383----
MW_605.33252@RT_1.875-ME806384----
MW_747.52194@RT_1.684-ME806385----
MW_763.51906@RT_1.677-ME806386----
MW_764.57149@RT_1.818-ME806387----
MW_793.54972@RT_1.717-ME806388----
MW_819.56496@RT_1.710-ME806389----
MW_843.56688@RT_1.705-ME806390----
MW_858.53001@RT_1.652-ME806391----
MW_867.56624@RT_1.697-ME806392----
MW_884.54470@RT_1.649-ME806393----
MW_886.56034@RT_1.647-ME806394----
MW_895.59669@RT_1.695-ME806395----
MW_97.97685@RT_8.603-ME806396----
myo-inositolMyo-inositolME806397----
N~2~-Acetyl-L-ornithineN-AcetylornithineME806404----
N6-METHYLLYSINEN(6)-MethyllysineME806403----
N-ACETYLASPARAGINEN-AcetylasparagineME806398----
N-acetylglutamineN-AcetylglutamineME806399----
N-ACETYLGLYCINEN-AcetylglycineME806400----
N-acetyllysineN(2)-AcetyllysineME806401----
N-acetylphenylalanineN-AcetylphenylalanineME806402----
Oleic acidOleic acidME806406----
O-phosphoethanolaminePhosphoethanolamineME806405----
OPHTHALMATEOphthalmic acidME806407----
ornithineOrnithineME806408----
Ornithine degenerate (RT = 14.706)-ME806409----
Ornithine degenerate (RT = 9.874)-ME806410----
orotateOrotic acidME806411----
palmitatePalmitic acidME806413----
Palmitoleic acidPalmitoleic acidME806414----
p-aminobenzoatep-Aminobenzoic acidME806412----
PANTOTHENATEPantothenic acidME806415----
ParaldehydeParaldehydeME806416----
phenylalaninePhenylalanineME806417----
phosphocholineCholine phosphateME806418----
phosphoenolpyruvatePhosphoenolpyruvic acidME806419----
PipecolatePipecolic acidME806420----
PregabalinPregabalinME806421----
prolineProlineME806422----
pseudouridinePseudouridineME806423----
PyridoxalPyridoxalME806424----
Pyroglutamic AcidPyroglutamic acidME806425----
Pyroglutamic Acid (2)Pyroglutamic acidME806426----
quinolinic_acidQuinolinic acidME806427----
Retinyl acetateRetinyl acetateME806428----
Ribose 1-phosphateRibose 1-phosphateME806429----
sarcosineSarcosineME806430----
serineSerineME806431----
Stearic acidStearic acidME806432----
succinateSuccinic acidME806433----
SuccinyladenosineSuccinyladenosineME806434----
Sulfuric acid-ME806435----
taurineTaurineME806436----
threonineThreonineME806437----
Tocopherolalpha-TocopherolME806438----
tryptophanTryptophanME806439----
tyrosineTyrosineME806440----
UDP-GlcNAcUDP-N-acetylglucosamineME806441----
UMPUMPME806442----
uracilUracilME806443----
Uracil degenerate-ME806444----
uric acidUric acidME806445----
uridineUridineME806446----
valineValineME806447----
xanthineXanthineME806448----
XYLITOL/ARABITOL/RIBITOL-ME806449----


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