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Analysis: Ion pair NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
2PG / 3PG m+0Phosphoglyceric acidME798305----
2PG / 3PG m+1Phosphoglyceric acidME798306----
2PG / 3PG m+2Phosphoglyceric acidME798307----
2PG / 3PG m+3Phosphoglyceric acidME798308----
6-phosphogluconate m+06-Phosphogluconic acidME798336----
6-phosphogluconate m+16-Phosphogluconic acidME798337----
6-phosphogluconate m+26-Phosphogluconic acidME798338----
6-phosphogluconate m+36-Phosphogluconic acidME798339----
6-phosphogluconate m+46-Phosphogluconic acidME798340----
6-phosphogluconate m+56-Phosphogluconic acidME798341----
6-phosphogluconate m+66-Phosphogluconic acidME798342----
Acetyl CoA m+0Acetyl-CoAME798423----
Acetyl CoA m+1Acetyl-CoAME798424----
Acetyl CoA m+10Acetyl-CoAME798433----
Acetyl CoA m+11Acetyl-CoAME798434----
Acetyl CoA m+12Acetyl-CoAME798435----
Acetyl CoA m+13Acetyl-CoAME798436----
Acetyl CoA m+14Acetyl-CoAME798437----
Acetyl CoA m+15Acetyl-CoAME798438----
Acetyl CoA m+16Acetyl-CoAME798439----
Acetyl CoA m+17Acetyl-CoAME798440----
Acetyl CoA m+18Acetyl-CoAME798441----
Acetyl CoA m+19Acetyl-CoAME798442----
Acetyl CoA m+2Acetyl-CoAME798425----
Acetyl CoA m+20Acetyl-CoAME798443----
Acetyl CoA m+21Acetyl-CoAME798444----
Acetyl CoA m+22Acetyl-CoAME798445----
Acetyl CoA m+23Acetyl-CoAME798446----
Acetyl CoA m+3Acetyl-CoAME798426----
Acetyl CoA m+4Acetyl-CoAME798427----
Acetyl CoA m+5Acetyl-CoAME798428----
Acetyl CoA m+6Acetyl-CoAME798429----
Acetyl CoA m+7Acetyl-CoAME798430----
Acetyl CoA m+8Acetyl-CoAME798431----
Acetyl CoA m+9Acetyl-CoAME798432----
ADP m+0ADPME798502----
ADP m+1ADPME798503----
ADP m+10ADPME798512----
ADP m+2ADPME798504----
ADP m+3ADPME798505----
ADP m+4ADPME798506----
ADP m+5ADPME798507----
ADP m+6ADPME798508----
ADP m+7ADPME798509----
ADP m+8ADPME798510----
ADP m+9ADPME798511----
AMP m+0AMPME798491----
AMP m+1AMPME798492----
AMP m+10AMPME798501----
AMP m+2AMPME798493----
AMP m+3AMPME798494----
AMP m+4AMPME798495----
AMP m+5AMPME798496----
AMP m+6AMPME798497----
AMP m+7AMPME798498----
AMP m+8AMPME798499----
AMP m+9AMPME798500----
Aspartate m+0Aspartic acidME798524----
Aspartate m+1Aspartic acidME798525----
Aspartate m+2Aspartic acidME798526----
Aspartate m+3Aspartic acidME798527----
Aspartate m+4Aspartic acidME798528----
ATP m+0ATPME798513----
ATP m+1ATPME798514----
ATP m+10ATPME798523----
ATP m+2ATPME798515----
ATP m+3ATPME798516----
ATP m+4ATPME798517----
ATP m+5ATPME798518----
ATP m+6ATPME798519----
ATP m+7ATPME798520----
ATP m+8ATPME798521----
ATP m+9ATPME798522----
Citrate/isocitrate m+0Citric acid/Isocitric acidME798313----
Citrate/isocitrate m+1Citric acid/Isocitric acidME798314----
Citrate/isocitrate m+2Citric acid/Isocitric acidME798315----
Citrate/isocitrate m+3Citric acid/Isocitric acidME798316----
Citrate/isocitrate m+4Citric acid/Isocitric acidME798317----
Citrate/isocitrate m+5Citric acid/Isocitric acidME798318----
Citrate/isocitrate m+6Citric acid/Isocitric acidME798319----
E4P m+0Erythrose 4-phosphateME798343----
E4P m+1Erythrose 4-phosphateME798344----
E4P m+2Erythrose 4-phosphateME798345----
E4P m+3Erythrose 4-phosphateME798346----
E4P m+4Erythrose 4-phosphateME798347----
F6P m+0Fructose 6-phosphateME798298----
F6P m+1Fructose 6-phosphateME798299----
F6P m+2Fructose 6-phosphateME798300----
F6P m+3Fructose 6-phosphateME798301----
F6P m+4Fructose 6-phosphateME798302----
F6P m+5Fructose 6-phosphateME798303----
F6P m+6Fructose 6-phosphateME798304----
FAD m+0FADME798395----
FAD m+1FADME798396----
FAD m+10FADME798405----
FAD m+11FADME798406----
FAD m+12FADME798407----
FAD m+13FADME798408----
FAD m+14FADME798409----
FAD m+15FADME798410----
FAD m+16FADME798411----
FAD m+17FADME798412----
FAD m+18FADME798413----
FAD m+19FADME798414----
FAD m+2FADME798397----
FAD m+20FADME798415----
FAD m+21FADME798416----
FAD m+22FADME798417----
FAD m+23FADME798418----
FAD m+24FADME798419----
FAD m+25FADME798420----
FAD m+26FADME798421----
FAD m+27FADME798422----
FAD m+3FADME798398----
FAD m+4FADME798399----
FAD m+5FADME798400----
FAD m+6FADME798401----
FAD m+7FADME798402----
FAD m+8FADME798403----
FAD m+9FADME798404----
Fructose 1,6-bisphosphate m+0Fructose 1,6-bisphosphateME798356----
Fructose 1,6-bisphosphate m+1Fructose 1,6-bisphosphateME798357----
Fructose 1,6-bisphosphate m+2Fructose 1,6-bisphosphateME798358----
Fructose 1,6-bisphosphate m+3Fructose 1,6-bisphosphateME798359----
Fructose 1,6-bisphosphate m+4Fructose 1,6-bisphosphateME798360----
Fructose 1,6-bisphosphate m+5Fructose 1,6-bisphosphateME798361----
Fructose 1,6-bisphosphate m+6Fructose 1,6-bisphosphateME798362----
Glutamic acid m+0Glutamic acidME798529----
Glutamic acid m+1Glutamic acidME798530----
Glutamic acid m+2Glutamic acidME798531----
Glutamic acid m+3Glutamic acidME798532----
Glutamic acid m+4Glutamic acidME798533----
Glutamic acid m+5Glutamic acidME798534----
Glutathione - oxidized m+0GlutathioneME798374----
Glutathione - oxidized m+1GlutathioneME798375----
Glutathione - oxidized m+10GlutathioneME798384----
Glutathione - oxidized m+11GlutathioneME798385----
Glutathione - oxidized m+12GlutathioneME798386----
Glutathione - oxidized m+13GlutathioneME798387----
Glutathione - oxidized m+14GlutathioneME798388----
Glutathione - oxidized m+15GlutathioneME798389----
Glutathione - oxidized m+16GlutathioneME798390----
Glutathione - oxidized m+17GlutathioneME798391----
Glutathione - oxidized m+18GlutathioneME798392----
Glutathione - oxidized m+19GlutathioneME798393----
Glutathione - oxidized m+2GlutathioneME798376----
Glutathione - oxidized m+20GlutathioneME798394----
Glutathione - oxidized m+3GlutathioneME798377----
Glutathione - oxidized m+4GlutathioneME798378----
Glutathione - oxidized m+5GlutathioneME798379----
Glutathione - oxidized m+6GlutathioneME798380----
Glutathione - oxidized m+7GlutathioneME798381----
Glutathione - oxidized m+8GlutathioneME798382----
Glutathione - oxidized m+9GlutathioneME798383----
Glutathione - reduced m+0GlutathioneME798363----
Glutathione - reduced m+1GlutathioneME798364----
Glutathione - reduced m+10GlutathioneME798373----
Glutathione - reduced m+2GlutathioneME798365----
Glutathione - reduced m+3GlutathioneME798366----
Glutathione - reduced m+4GlutathioneME798367----
Glutathione - reduced m+5GlutathioneME798368----
Glutathione - reduced m+6GlutathioneME798369----
Glutathione - reduced m+7GlutathioneME798370----
Glutathione - reduced m+8GlutathioneME798371----
Glutathione - reduced m+9GlutathioneME798372----
Lactate m+0Lactic acidME798535----
Lactate m+1Lactic acidME798536----
Lactate m+2Lactic acidME798537----
Lactate m+3Lactic acidME798538----
Malate m+0D-Malic acidME798325----
Malate m+1D-Malic acidME798326----
Malate m+2D-Malic acidME798327----
Malate m+3D-Malic acidME798328----
Malate m+4D-Malic acidME798329----
NAD m+0NADME798447----
NAD m+1NADME798448----
NAD m+10NADME798457----
NAD m+11NADME798458----
NAD m+12NADME798459----
NAD m+13NADME798460----
NAD m+14NADME798461----
NAD m+15NADME798462----
NAD m+16NADME798463----
NAD m+17NADME798464----
NAD m+18NADME798465----
NAD m+19NADME798466----
NAD m+2NADME798449----
NAD m+20NADME798467----
NAD m+21NADME798468----
NAD m+3NADME798450----
NAD m+4NADME798451----
NAD m+5NADME798452----
NAD m+6NADME798453----
NAD m+7NADME798454----
NAD m+8NADME798455----
NAD m+9NADME798456----
NADP m+0NADPME798469----
NADP m+1NADPME798470----
NADP m+10NADPME798479----
NADP m+11NADPME798480----
NADP m+12NADPME798481----
NADP m+13NADPME798482----
NADP m+14NADPME798483----
NADP m+15NADPME798484----
NADP m+16NADPME798485----
NADP m+17NADPME798486----
NADP m+18NADPME798487----
NADP m+19NADPME798488----
NADP m+2NADPME798471----
NADP m+20NADPME798489----
NADP m+21NADPME798490----
NADP m+3NADPME798472----
NADP m+4NADPME798473----
NADP m+5NADPME798474----
NADP m+6NADPME798475----
NADP m+7NADPME798476----
NADP m+8NADPME798477----
NADP m+9NADPME798478----
Oxoglutaric acid m+02-Oxoglutaric acidME798543----
Oxoglutaric acid m+12-Oxoglutaric acidME798544----
Oxoglutaric acid m+22-Oxoglutaric acidME798545----
Oxoglutaric acid m+32-Oxoglutaric acidME798546----
Oxoglutaric acid m+42-Oxoglutaric acidME798547----
Oxoglutaric acid m+52-Oxoglutaric acidME798548----
Pyruvate m+0Pyruvic acidME798539----
Pyruvate m+1Pyruvic acidME798540----
Pyruvate m+2Pyruvic acidME798541----
Pyruvate m+3Pyruvic acidME798542----
R5P m+0Ribose 5-phosphateME798330----
R5P m+1Ribose 5-phosphateME798331----
R5P m+2Ribose 5-phosphateME798332----
R5P m+3Ribose 5-phosphateME798333----
R5P m+4Ribose 5-phosphateME798334----
R5P m+5Ribose 5-phosphateME798335----
S7P m+0Sedoheptulose 7-phosphateME798348----
S7P m+1Sedoheptulose 7-phosphateME798349----
S7P m+2Sedoheptulose 7-phosphateME798350----
S7P m+3Sedoheptulose 7-phosphateME798351----
S7P m+4Sedoheptulose 7-phosphateME798352----
S7P m+5Sedoheptulose 7-phosphateME798353----
S7P m+6Sedoheptulose 7-phosphateME798354----
S7P m+7Sedoheptulose 7-phosphateME798355----
sn-Glycero-3-phosphate m+0sn-Glycero-3-phosphateME798309----
sn-Glycero-3-phosphate m+1sn-Glycero-3-phosphateME798310----
sn-Glycero-3-phosphate m+2sn-Glycero-3-phosphateME798311----
sn-Glycero-3-phosphate m+3sn-Glycero-3-phosphateME798312----
Succinate m+0Succinic acidME798320----
Succinate m+1Succinic acidME798321----
Succinate m+2Succinic acidME798322----
Succinate m+3Succinic acidME798323----
Succinate m+4Succinic acidME798324----


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