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Record Information
HMDB Statusexpected
Creation Date2024-02-21 00:27:13 UTC
Update Date2025-03-21 18:39:52 UTC
HMDB IDHMDB0034666
Metabolite Identification
DeepMet IDDMID00127549
Name(±)-2-Hydroxy-2-phenylacetonitrile
Frequency20.0
Structure
Chemical FormulaC8H7NO
Molecular Mass133.0528
SMILESN#CC(O)c1ccccc1
InChI KeyNNICRUQPODTGRU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha-hydroxynitriles
  • aromatic alcohols
  • cyanohydrins
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • nitrile
  • cyanohydrin
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • alpha-hydroxynitrile
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • carbonitrile
  • organooxygen compound