RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet IDRM0042351
RefMet nameAcetaminophen
Systematic nameN-(4-hydroxyphenyl)acetamide
SynonymsPubChem Synonyms
Exact mass151.063329 (neutral)
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View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC8H9NO2View other entries in RefMet with this formula
Molecular descriptors
Molfile37895 (Download molfile/View MW Metabolite Database details)
InChIInChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)
InChIKeyRZVAJINKPMORJF-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
SMILESCC(=O)Nc1ccc(cc1)O
Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super ClassBenzenoids
Main ClassPhenols
Sub ClassAminophenols
Distribution of Acetaminophen in NMDR studies
SpeciesPlot Species distribution
Sample sourcePlot Sample source(tissue) distribution
StudiesNMDR Studies reporting Acetaminophen
External Links
Pubchem CID1983
ChEBI ID46195
KEGG IDC06804
HMDB IDHMDB0001859
Chemspider ID1906
MetaCyc IDCPD-7669
EPA CompToxDTXCID606
Spectral data for Acetaminophen standards
MassBank(EU)View MS spectra
Structural annotation level
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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