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Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
1,5-Anhydroglucitol1,5-AnhydrosorbitolME228592----
Dehydroalanine (possibly from cysteine)2-Aminoacrylic acidME228643----
2-Hydroxyglutaric acid2-Hydroxyglutaric acidME228594----
2-Hydroxypyridine2-HydroxypyridineME228595----
beta-Hydroxybutyric acid3-Hydroxybutyric acidME228618----
3-Phosphoglyceric acid3-Phosphoglyceric acidME228598----
4-Hydroxypyridine4-PyridoneME228599----
5'-Deoxy-5'-(methylthio) adenosine5'-MethylthioadenosineME228601----
6-Hydroxynicotinic acid6-Hydroxynicotinic acidME228602----
6-Methyluracil6-MethyluracilME228603----
AdenineAdenineME228604----
AlanineAlanineME228607----
2-Aminoadipic acidalpha-Aminoadipic acidME228593----
alpha-Tocopherolalpha-TocopherolME228610----
Aminomalonic acidAminomalonic acidME228611----
Adenosine-5-monophosphateAMPME228605----
PentitolsArabitolME228701----
Arachidonic acid (also Eicosapentaenoic acid)Arachidonic acidME228613----
ArginineArginineME228614----
AsparagineAsparagineME228615----
Aspartic acidAspartic acidME228616----
Docosanoic acidBehenic acidME228650----
Benzoic acidBenzoic acidME228617----
CampesterolCampesterolME228637----
Decanoic acidCapric acidME228642----
Hexanoic acid (and/or Glycolic acid)Caproic acidME228666----
Chenodeoxycholic acidChenodeoxycholic acidME228638----
CholesterolCholesterolME228639----
Citric acid/isocitric acidCitric acid/Isocitric acidME228640----
CreatinineCreatinineME228641----
DiethanolamineDiethanolamineME228646----
Dihydroxyacetone phosphateDihydroxyacetone phosphateME228647----
Docosahexaenoic acidDocosahexaenoic acidME228649----
EthanolamineEthanolamineME228651----
Fumaric acidFumaric acidME228653----
gamma-Tocopherolgamma-TocopherolME228654----
Glutamic acidGlutamic acidME228657----
GlutamineGlutamineME228658----
GlycerolGlycerolME228660----
GlycineGlycineME228662----
Glycolic acidGlycolic acidME228663----
Glyoxylic acidGlyoxylic acidME228664----
Gly-ProGly-ProME228659----
Glucose and other aldohexosesHexoseME228655----
Glucose-6-phosphate or similarHexose 6-phosphateME228656----
Sucrose and similar disaccharidesHexose disaccharideME228728----
HistidineHistidineME228668----
HomoserineHomoserineME228669----
HypotaurineHypotaurineME228671----
HypoxanthineHypoxanthineME228672----
Inosine 5'-monophosphateIMPME228673----
Fructose or similar ketohexoseKetohexoseME228652----
Lactic acidLactic acidME228677----
Dehydroascorbic acid (possibly alpha-ketoglutarate...L-Dehydroascorbic acidME228644----
Isoleucine/LeucineLeucine/IsoleucineME228675----
Linoleic acidLinoleic acidME228678----
LysineLysineME228679----
Maleic acidMaleic acidME228680----
Malic acidMalic acidME228681----
O-MethylphosphateMethanolphosphateME228693----
MethionineMethionineME228682----
Methionine sulfoxideMethionine sulfoxideME228683----
beta-MonopalmitinMG 0:0/16:0/0:0ME228619----
beta-MonostearinMG 0:0/18:0/0:0ME228620----
alpha-MonopalmitinMG 16:0/0:0/0:0ME228608----
alpha-MonostearinMG 18:0/0:0/0:0ME228609----
MyoinositolMyo-inositolME228685----
Myoinositol-2-phosphatemyo-Inositol 2-phosphateME228686----
Myristic acid or PentadecanolMyristic acidME228687----
N-Acetylneuraminic acidN-Acetylneuraminic acidME228688----
NicotinamideNiacinamideME228690----
Nicotinic acidNicotinic acidME228691----
Oleic acidOleic acidME228695----
Palmitic acidPalmitic acidME228697----
Palmitoleic acidPalmitoleic acidME228698----
Pantothenic acidPantothenic acidME228699----
Nonanoic acidPelargonic acidME228692----
PhenolPhenolME228702----
PhenylalaninePhenylalanineME228703----
Phosphoenolpyruvic acidPhosphoenolpyruvic acidME228704----
O-PhosphocolaminePhosphoethanolamineME228694----
Phosphoric acidPhosphoric acidME228705----
PseudouridinePseudouridineME228708----
PutrescinePutrescineME228709----
PyrophosphatePyrophosphateME228710----
Pyrrole -2-carboxylic acidPyrrole-2-carboxylic acidME228711----
Pyruvic acidPyruvic acidME228712----
SerineSerineME228713----
beta-SitosterolSitosterolME228621----
Glycerol 1-phosphatesn-Glycero-3-phosphateME228661----
SpermidineSpermidineME228722----
SpermineSpermineME228723----
SqualeneSqualeneME228724----
StearamideStearamideME228725----
Stearic acidStearic acidME228726----
Succinic acidSuccinic acidME228727----
TaurineTaurineME228729----
ThreonineThreonineME228731----
Tiglic acidTiglic acidME228732----
TyrosineTyrosineME228735----
UracilUracilME228737----
UreaUreaME228738----
Uric acidUric acidME228739----
UridineUridineME228740----
ValineValineME228741----
Xanthine (and/or Cytindine-5'-monophosphate)XanthineME228742----
1-Eicosanol/Nonadecanoic acid-ME228591----
3-Aminoisobutyric acid/beta-Alanine-ME228596----
3-Indolelactic acid/Tryptophan-ME228597----
5-alpha-Coprostanol or similar oxysterol-ME228600----
Adenosine/Inosine-ME228606----
Arachidic acid/ 1-Heneicosanol-ME228612----
C10 hydrocarbon-ME228622----
C11 hydrocarbon-ME228623----
C12 hydrocarbon-ME228624----
C13 hydrocarbon-ME228625----
C14 Hydrocarbon-ME228626----
C15 hydrocarbon-ME228627----
C16 Hydrocarbon-ME228628----
C17 hydrocarbon-ME228629----
C19 hydrocarbon-ME228630----
C20 Hydrocarbon-ME228631----
C21 Hydrocarbon-ME228632----
C22 hydrocarbon-ME228633----
C23 Hydrocarbon-ME228634----
C24 Hydrocarbon-ME228635----
C25 hydrocarbon-ME228636----
deuterated Myristic Acid (RTL std)-ME228645----
Disaccharide-ME228648----
Heptadecanoic acid/Octadecanol-ME228665----
Hexitols-ME228667----
Hydroxyprolines-ME228670----
Inosine/Adenosine-ME228674----
Ketopentose-5-phosphate-ME228676----
MSTFA artifact-ME228684----
N-Methylalanine/2-Aminobutanoic acid/N-Ethylglycin...-ME228689----
Pentadecanoic acid/Hexadecanol-ME228700----
p-Hydroxyphenyllactic acid-ME228696----
possibly Erythritol/Theitol-ME228706----
Prunetin or similar isoflavone-ME228707----
Siloxanes_R1-ME228714----
Siloxanes_R2-ME228715----
Siloxanes_R3-ME228716----
Siloxanes_R4-ME228717----
Siloxanes_R5-ME228718----
Siloxanes_R6-ME228719----
Siloxanes_R7-ME228720----
Siloxanes_R8-ME228721----
Threonic acid/erythronic acid-ME228730----
Tris-ME228733----
Tryptamine/Norepinephrine-ME228734----
Unknown-possibly propylene glycol-ME228736----


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