RefMet Compound Details

MW structure37895 (View MW Metabolite Database details)
RefMet nameAcetaminophen
Systematic nameN-(4-hydroxyphenyl)acetamide
SMILESCC(=O)Nc1ccc(O)cc1
Exact mass151.063329 (neutral)
Calculate m/z:   
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
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
Super ClassBenzenoids
Main ClassPhenols
Sub ClassAminophenols
Pubchem CID1983
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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