Exact Mass: 226.156
Exact Mass Matches: 226.156
Found 195 metabolites which its exact mass value is equals to given mass value 226.156
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
4,4-Methylene di-o-toluidine
CONFIDENCE standard compound; INTERNAL_ID 322; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5346; ORIGINAL_PRECURSOR_SCAN_NO 5344 CONFIDENCE standard compound; INTERNAL_ID 322; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5297; ORIGINAL_PRECURSOR_SCAN_NO 5295 CONFIDENCE standard compound; INTERNAL_ID 322; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5346; ORIGINAL_PRECURSOR_SCAN_NO 5345 CONFIDENCE standard compound; INTERNAL_ID 322; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5344; ORIGINAL_PRECURSOR_SCAN_NO 5342 CONFIDENCE standard compound; INTERNAL_ID 322; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5314; ORIGINAL_PRECURSOR_SCAN_NO 5313 CONFIDENCE standard compound; INTERNAL_ID 322; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5349; ORIGINAL_PRECURSOR_SCAN_NO 5348 CONFIDENCE standard compound; INTERNAL_ID 4142
6-Methylergoline
An ergoline alkaloid obtained by selective methylation of the N-6 position of ergoline.
Methyl dihydrojasmonate
Methyl dihydrojasmonate is a flavouring ingredient.Methyl dihydrojasmonate is an ester and a diffusive aroma compound, with the smell vaguely similar to jasmin. In racemic mixtures the odour is floral and citrus while epimerized mixtures exhibit a dense fatty floral odour with odor recognition thresholds of 15 part per billion Flavouring ingredient [DFC] Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1]. Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1].
4,5-Dihydrovomifoliol
4,5-Dihydrovomifoliol is found in alcoholic beverages. 4,5-Dihydrovomifoliol is a constituent of Vitis vinifera grapes and Riesling wine. Constituent of Vitis vinifera grapes and Riesling wine. 4,5-Dihydrovomifoliol is found in alcoholic beverages and fruits.
Riesling acetal
Riesling acetal is found in alcoholic beverages. Riesling acetal is a constituent of Riesling wine. Constituent of Riesling wine. Riesling acetal is found in alcoholic beverages.
2-[(Z)-[(4Z)-4-(Diaminomethylidenehydrazinylidene)hexan-3-ylidene]amino]guanidine
Pirlindole
D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D004791 - Enzyme Inhibitors > D008996 - Monoamine Oxidase Inhibitors C471 - Enzyme Inhibitor > C667 - Monoamine Oxidase Inhibitor D000970 - Antineoplastic Agents
3,9-Dimethyl-6-(1-methylethyl)-1,4-dioxaspiro[4.5]decan-2-one
It is used as a food additive .
Methyl dihydroepijasmonate
Flavouring compound [Flavornet]
N-Desmethylpheniramine
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3420 CONFIDENCE standard compound; INTERNAL_ID 2122
N-Isopropyl-N-phenyl-p-phenylenediamine
D020011 - Protective Agents > D000975 - Antioxidants CONFIDENCE standard compound; INTERNAL_ID 2425
(2R*,4S*,5E)-2-hydroxy-7-isopropyl-4-methyl-5-nonen-4-olide|(2R*,4S*,5E,7xi)-5-(3-Ethyl-4-methyl-1-pentenyl)-4,5-dihydro-3-hydroxy-5-methyl-2(3H)furanone
(2R*)-1-[(1S*,4S*,5S*,8R*)-1,8-dimethyl-2,7-dioxabicyclo[3.2.1]oct-4-yl]-2-methylbutan-1-one|colomitide A
(3S,5R,6R)-5,6-dihydro-5-hydroxy-3,6-epoxy-pi-ionol|5,6-Dihydro 5-hydroxy-3,6-epoxy-beta-ionol
4R-hydroxy-4-(9S-hydroxy-12-methylhexan-6-yl)-3-methylcyclopent-2-enone
(2R,3R,4S,5R)-3-hydroxy-2,4-dimethyl-5-[(S,Z)-3-methylpentenyl]-tetrahydro-pyranone
1,5,5-Trimethyl-6-(3,4-dihydroxybutyl)-1-cyclohexene-3-one
(-)-(5R,6R)-5,6-dihydroxy-5,6-dihydro-beta-ionone|5,6-dihydroxy-5,6-dihydro-beta-jonone|dihydroxy-beta-ionone
3alpha,5beta-dihydroxy-4alpha,11-epoxybisnorcadinane
Blumenol B
9-Epiblumenol B is a sesquiterpenoid. 9-Epiblumenol B is a natural product found in Phyllanthus polyphyllus and Phyllanthus lawii with data available.
Methyl_dihydrojasmonate
Methyl 2-(3-oxo-2-pentylcyclopentyl)acetate is a lipid. It is functionally related to a jasmonic acid. Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1]. Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1].
Hedione
Acquisition and generation of the data is financially supported in part by CREST/JST. Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1]. Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1].
N-isopropyl-N-phenyl-p-phenylenediamine
D020011 - Protective Agents > D000975 - Antioxidants CONFIDENCE standard compound; INTERNAL_ID 4137
Methyl dihydrojasmonate
Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1]. Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1].
2-(7-hydroxy-6-methyloctyl)-2H-furan-5-one
2-(6-hydroxy-6-methyloctyl)-2H-furan-5-one
NPE_227.1543_9.6
CONFIDENCE Parent Substance with Reference Standard (Level 1); INTERNAL_ID 1100
C13H22O3_2-Cyclohexen-1-one, 4-hydroxy-4-(3-hydroxybutyl)-3,5,5-trimethyl
DIHYDROJASMONIC ACID, METHYL ESTER
Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1]. Methyl dihydrojasmonate is a fragrance ingredient with a jasmine-like odor, used in many fragrance mixtures[1].
2-[3-(Acetyloxy)-1-methylpropyl]-5-methylcyclohexanone
1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE
1-(5,5,8a-Trimethyl-3,5,6,7,8,8a-hexahydro-1,2-benzodioxin-3-yl)ethanol
6-[(1E)-3-Hydroxy-1-butenyl]-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol
2,6,6-Trimethyl-1,2-epoxy-1-(4-hydroxy-2,3-epoxybutan-1-yl)cyclohexane
2-(Piperidin-1-yl)-2,3-dihydro-1H-indene-2-carbonitrile
Cyclopentaneacetic acid, 3-oxo-2-pentyl-, methyl ester, (1S-cis)-
Pirlindole
D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D004791 - Enzyme Inhibitors > D008996 - Monoamine Oxidase Inhibitors C471 - Enzyme Inhibitor > C667 - Monoamine Oxidase Inhibitor D000970 - Antineoplastic Agents
2-[(E)-[(4E)-4-(diaminomethylidenehydrazinylidene)hexan-3-ylidene]amino]guanidine
1,2,3,4,8,9,10,11-octahydro-[1,4]diazepino[6,7,1-jk]carbazole
Methyl (1S,2R,4S,(4A)R,(8A)R)-decahydro-4-hydroxy-2-methylnaphthalen-1-carboxylate
4-Hydroxy-4-[(E)-3-hydroxybut-1-enyl]-3,3,5-trimethylcyclohexan-1-one
methyl 2-[3-hydroxy-2-(pent-2-en-1-yl)cyclopentyl]acetate
(4s,5s)-4-hydroxy-4-[(1e,3r)-3-hydroxybut-1-en-1-yl]-3,3,5-trimethylcyclohexan-1-one
(4s)-4-hydroxy-4-[(3r)-3-hydroxybutyl]-3,5,5-trimethylcyclohex-2-en-1-one
(2e,7s,8s,11e)-7,8-dihydroxytrideca-2,11-dien-6-one
(1r,3s)-6-[(3r)-3-hydroxybut-1-en-1-ylidene]-1,5,5-trimethylcyclohexane-1,3-diol
4-hydroxy-3,5-dimethyl-6-(3-methylpent-1-en-1-yl)oxan-2-one
5-ethyl-4-hydroxy-3-methoxy-5-methyl-2-(sec-butyl)cyclopent-2-en-1-one
4-hydroxy-4-(3-hydroxybut-1-en-1-yl)-3,3,5-trimethylcyclohexan-1-one
6-hydroxy-4-(3-hydroxybutyl)-3,5,5-trimethylcyclohex-2-en-1-one
4-(3-hydroxybut-1-en-1-yl)-3,5,5-trimethylcyclohex-3-ene-1,2-diol
(4s,6r)-6-hydroxy-4-[(3r)-3-hydroxybutyl]-3,5,5-trimethylcyclohex-2-en-1-one
(5r)-3-[(1r)-1-hydroxyoctyl]-5-methyl-5h-furan-2-one
2-hydroxy-1,1,10-trimethyl-6,9-epidioxydecalin
{"Ingredient_id": "HBIN005709","Ingredient_name": "2-hydroxy-1,1,10-trimethyl-6,9-epidioxydecalin","Alias": "NA","Ingredient_formula": "C13H22O3","Ingredient_Smile": "CC1(C(CCC2(C13CCC(C2)OO3)C)O)C","Ingredient_weight": "226.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40808","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "538297","DrugBank_id": "NA"}
(2r,6r,9r)-2,9-dihydroxy-4-megastigmen-3-one
{"Ingredient_id": "HBIN006530","Ingredient_name": "(2r,6r,9r)-2,9-dihydroxy-4-megastigmen-3-one","Alias": "NA","Ingredient_formula": "C13H22O3","Ingredient_Smile": "CC1=CC(=O)C(C(C1CCC(C)O)(C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5957","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s,5r,6s,7 e,9r)-5,6-epoxy-3,9-dihydroxy-7-megastigmene
{"Ingredient_id": "HBIN009657","Ingredient_name": "(3s,5r,6s,7 e,9r)-5,6-epoxy-3,9-dihydroxy-7-megastigmene","Alias": "NA","Ingredient_formula": "C13H22O3","Ingredient_Smile": "CC(C=CC12C(CC(CC1(O2)C)O)(C)C)O","Ingredient_weight": "226.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7078","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "23251169","DrugBank_id": "NA"}
(3S, SR, 6S, 7E,9R)-5, 6-epoxy-3, 9-dihydroxy-7-megastigmene
{"Ingredient_id": "HBIN009732","Ingredient_name": "(3S, SR, 6S, 7E,9R)-5, 6-epoxy-3, 9-dihydroxy-7-megastigmene","Alias": "NA","Ingredient_formula": "C13H22O3","Ingredient_Smile": "CC(C=CC12C(CC(CC1(O2)C)O)(C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41392","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
annuionone e
{"Ingredient_id": "HBIN016243","Ingredient_name": "annuionone e","Alias": "NA","Ingredient_formula": "C13H22O3","Ingredient_Smile": "CC(CCC1C2(CC(=O)CC1(OC2)C)C)O","Ingredient_weight": "226.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1336","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101260349","DrugBank_id": "NA"}
annuionone g
{"Ingredient_id": "HBIN016245","Ingredient_name": "annuionone g","Alias": "NA","Ingredient_formula": "C13H22O3","Ingredient_Smile": "CC(C=C=C1C(CC(CC1(C)O)O)(C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1338","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}