Exact Mass: 248.00626139999997
Exact Mass Matches: 248.00626139999997
Found 109 metabolites which its exact mass value is equals to given mass value 248.00626139999997,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Linuron
C9H10Cl2N2O2 (248.01193000000004)
CONFIDENCE standard compound; INTERNAL_ID 48; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4724; ORIGINAL_PRECURSOR_SCAN_NO 4722 CONFIDENCE standard compound; INTERNAL_ID 48; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4711; ORIGINAL_PRECURSOR_SCAN_NO 4707 CONFIDENCE standard compound; INTERNAL_ID 48; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4718; ORIGINAL_PRECURSOR_SCAN_NO 4717 CONFIDENCE standard compound; INTERNAL_ID 48; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4709; ORIGINAL_PRECURSOR_SCAN_NO 4707 CONFIDENCE standard compound; INTERNAL_ID 48; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4732; ORIGINAL_PRECURSOR_SCAN_NO 4729 CONFIDENCE standard compound; INTERNAL_ID 48; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4811; ORIGINAL_PRECURSOR_SCAN_NO 4807 CONFIDENCE standard compound; EAWAG_UCHEM_ID 160 CONFIDENCE standard compound; INTERNAL_ID 8412 CONFIDENCE standard compound; INTERNAL_ID 4031 CONFIDENCE standard compound; INTERNAL_ID 2323 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
1,1-Bis(4-chlorophenyl)ethylene
C14H10Cl2 (248.01595200000003)
1-Chloro-2-[1-(4-chlorophenyl)ethenyl]benzene
C14H10Cl2 (248.01595200000003)
Vanillic acid 4-O-sulfate
Vanillic acid 4-O-sulfate is a polyphenol metabolite detected in biological fluids (PMID: 20428313). Vanillic acid 4-O-sulfate was found to be elevated in rat urine after whole rye consumption which makes this compound a potential urinary biomarker of whole grain intake (PMID: 26862900).
2-[4-hydroxy-3-(sulfooxy)phenyl]acetic acid
2-[4-hydroxy-3-(sulfooxy)phenyl]acetic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 2-(3,4-dihydroxyphenyl)acetic acid. It is generated by Sulfotransferase 1A3 (P0DMM9) and Sulfotransferase enzymes via a -3-O-sulfation-of-phenolic-compound reaction. This -3-O-sulfation-of-phenolic-compound occurs in humans.
4-methoxy-3-(sulfooxy)benzoic acid
4-methoxy-3-(sulfooxy)benzoic acid is a predicted metabolite generated by BioTransformer¹ that is produced by the metabolism of 3-hydroxy-4-methoxybenzoic acid. It is generated by Sulfotransferase 1A3 (P0DMM9) and Sulfotransferase enzymes via a -3-O-sulfation-of-phenolic-compound reaction. This -3-O-sulfation-of-phenolic-compound occurs in humans.
(1,2-Dichloro-2-phenylethenyl)benzene
C14H10Cl2 (248.01595200000003)
Ethene, 1,1-diphenyl-2,2-dichloro-
C14H10Cl2 (248.01595200000003)
Arctic acid
Arctic acid, also known as arctate, is a member of the class of compounds known as bi- and oligothiophenes. Bi- and oligothiophenes are organic compounds containing two or more linked thiophene rings. Thiophene is a five-member aromatic ring with one sulfur and four carbon atoms. Arctic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Arctic acid can be found in burdock, which makes arctic acid a potential biomarker for the consumption of this food product.
1-Chloro-4-[5-(1, 3-pentadiynyl)-2-thienyl]-3-butyn-2-ol, 9CI
C13H9ClOS (248.00626139999997)
5-(1-propynyl)-2,2-bithienyl-5-carboxylic acid|Arctic acid
(10Z)-10-bromo-3-chloro-alpha-myrcene|(E)-10-Bromo-3-chloro-alpha-myrcen|6-(Z)-bromomethylene-3-chloro-2-methyl-octa-1,7-diene
3-(Z)-bromomethylene-2-chloro-7-methyl-octa-1,6-diene
1-chloro-4-[5-(penta-1,3-diyn-1-yl)-2-thienyl]-but-3-yn-2-ol|2-(4-Chloro-3-hydroxybut-1-ynyl)-5-(penta-1,3-diynyl) thiophene
C13H9ClOS (248.00626139999997)
2-(1-propynyl)-5-(6-chloro-5-hydroxyhex-3-yn-1-ynyl)-thiophene|5--6-chloro-5-hydroxyhexa-3,5-diyne
C13H9ClOS (248.00626139999997)
2-(1-propynyl)-5-(5-chloro-6-hydroxyhex-3-yn-1-ynl)-thiophene
C13H9ClOS (248.00626139999997)
2--5-<3-chlor-4-hydroxy-butin-(1)-yl>-thiophen|2-chloro-4-(5-penta-1,3-diynyl-thiophen-2-yl)-but-3-yn-1-ol|2-Chloro-4-[5-(1,3-Pentadiynyl)-2-thienyl]-3-butyn-1-ol|2-chloro-4-[5-(penta-1,3-diyn-1-yl)-2-thienyl]-but-3-yn-1-ol
C13H9ClOS (248.00626139999997)
LINURON
C9H10Cl2N2O2 (248.01193000000004)
D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
1-chloro-4-(5-(penta-1,3-diyn-1-yl)thiophen-2-yl)but-3-yn-2-ol
C13H9OSCl (248.00626139999997)
3,5-dichloro-4-propoxybenzoic acid
C10H10Cl2O3 (248.00069700000003)
2-[(4-CHLOROPHENYL)SULFONYL]-N-HYDROXYETHANIMIDAMIDE
2-(3,4-DICHLOROPHENOXY)PROPANOHYDRAZIDE
C9H10Cl2N2O2 (248.01193000000004)
4,5-Dichloro-2-(tetrahydro-pyran-2-yl)-2H-pyridazin-3-one
C9H10Cl2N2O2 (248.01193000000004)
2,6-Dihydroxypyrrolo(3,4-f)isoindole-1,3,5,7(2H,6H)-tetrone
8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbaldehyde
4-methyl-2,3-dihydropyrido[3,2-b][1,4]oxazine-7-sulfonyl chloride
3,5-DICHLORO-4-HYDROXYBENZOIC ACID PROPYL ESTER
C10H10Cl2O3 (248.00069700000003)
2-(4-chlorophenylthio)benzaldehyde
C13H9ClOS (248.00626139999997)
ethyl 2-(2,5-dichlorophenoxy)acetate
C10H10Cl2O3 (248.00069700000003)
1-(4-CHLORO-PHENYL)-2-ISOPROPYLAMINO-ETHANOL
C13H9ClOS (248.00626139999997)
2-(4-CHLOROPHENYL)-3,5-DIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZINE-6-CARBONITRILE
C10H5ClN4O2 (248.01010200000002)
6-Chloro-3-(1H-tetrazol-5-yl)-4H-chromen-4-one
C10H5ClN4O2 (248.01010200000002)
ALPHA-(TRIFLUOROMETHYL)-3-PYRIDINEMETHANAMINEHYDROCHLORIDE
C7H9Cl2F3N2 (248.00948499999998)
3,5-DICHLORO-4-METHOXYBENZOIC ACID ETHYL ESTER
C10H10Cl2O3 (248.00069700000003)
2-(2,4-dichlorophenoxy)propionic acid hydrazide
C9H10Cl2N2O2 (248.01193000000004)
2-(2,4-dichlorophenoxy)-2-methyl-propanoic acid
C10H10Cl2O3 (248.00069700000003)
2-(3,5-Dichlorophenoxy)-2-methylpropanoic acid
C10H10Cl2O3 (248.00069700000003)
7-Chloro-6-nitro-1,2,3,4-tetrahydroisoquinoline hydrochloride
C9H10Cl2N2O2 (248.01193000000004)
(4-(TRIFLUOROMETHYL)PYRIDIN-2-YL)METHANAMINE DIHYDROCHLORIDE
C7H9Cl2F3N2 (248.00948499999998)
4,5,6,7-tetrafluoro-2-methyl-1-benzofuran-3-carboxylic acid
ethyl 2-(2,6-dichlorophenoxy)acetate
C10H10Cl2O3 (248.00069700000003)
1-[6-(Trifluoromethyl)-2-pyridinyl]methanamine dihydrochloride
C7H9Cl2F3N2 (248.00948499999998)
6-(thiophen-2-ylmethyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
C11H8N2OS2 (248.00780379999998)
2,3,5,6-TETRAFLUORO-4-(TRIFLUOROMETHYL)BENZYL ALCOHOL
Ethyl 3-(3,4-Dichlorophenyl)carbazate
C9H10Cl2N2O2 (248.01193000000004)
[2-(2-CHLORO-ACETYLAMINO)-THIAZOL-5-YL]-ACETIC ACID METHYL ESTER
3-TRIFLUOROMETHANESULFONYLOXY-BUT-2-ENOIC ACID METHYL ESTER
C6H7F3O5S (247.99662880000002)
Butanoic acid,2-(2,4-dichlorophenoxy)-
C10H10Cl2O3 (248.00069700000003)
Ethene, 1,1-diphenyl-2,2-dichloro-
C14H10Cl2 (248.01595200000003)
(1,2-Dichloro-2-phenylethenyl)benzene
C14H10Cl2 (248.01595200000003)
2,4-Dichlorophenoxybutyric acid
C10H10Cl2O3 (248.00069700000003)
(4-Amino-1-hydroxy-1-phosphono-butyl)phosphonic acid
Alendronate(1-)
D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates
2,4-dihydroxyacetophenone-5-O-sulfate
An acetophenone substituted by hydroxy groups at positions 2 and 4, and by a sulfooxy group at position 5. It is a metabolite of the Chinese medicine Shuangdan granule.
cis-4-(3-Hydroxy-1-benzothiophen-2-yl)-2-oxobut-3-enoic acid
4-(3-Hydroxy-1-benzothiophen-2-yl)-2-oxobut-3-enoic acid
2-chloro-6-[5-(prop-1-yn-1-yl)thiophen-2-yl]hexa-3,5-diyn-1-ol
C13H9ClOS (248.00626139999997)
1-chloro-6-[5-(prop-1-yn-1-yl)thiophen-2-yl]hexa-3,5-diyn-2-ol
C13H9ClOS (248.00626139999997)
(2s)-2-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-ol
C13H9ClOS (248.00626139999997)
(3r,6z)-6-(bromomethylidene)-3-chloro-2-methylocta-1,7-diene
2-bromo-3-(chloromethylidene)-7-methylocta-1,6-diene
(2s)-1-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-2-ol
C13H9ClOS (248.00626139999997)
4-bromo-6-chloro-1-ethenyl-5,5-dimethylcyclohex-1-ene
6-bromo-2-chloro-7-methyl-3-methylideneocta-1,6-diene
2,3,5-tris(methylsulfanyl)benzene-1,4-diol
C9H12O2S3 (247.99994120000002)
1-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-2-ol
C13H9ClOS (248.00626139999997)
(6z)-6-(bromomethylidene)-3-chloro-2-methylocta-1,7-diene
3-(bromomethylidene)-2-chloro-7-methylocta-1,6-diene
2-chloro-4-[5-(penta-1,3-diyn-1-yl)thiophen-2-yl]but-3-yn-1-ol
C13H9ClOS (248.00626139999997)
(3e)-2-bromo-3-(chloromethylidene)-7-methylocta-1,6-diene
(3z)-3-(bromomethylidene)-2-chloro-7-methylocta-1,6-diene
(2r)-2-chloro-6-[5-(prop-1-yn-1-yl)thiophen-2-yl]hexa-3,5-diyn-1-ol
C13H9ClOS (248.00626139999997)