Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:23:16 UTC
Update Date2025-03-21 22:17:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00540397
Frequency3.1
Structure
Chemical FormulaC9H11F
Molecular Mass138.0845
SMILESCC(C)c1cccc(F)c1
InChI KeyNAYXHKRRAWPEKG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl fluorides
  • fluorobenzenes
  • hydrocarbon derivatives
  • hydrofluorocarbons
  • organofluorides
  • phenylpropanes
  • Substituents
  • aryl fluoride
  • organofluoride
  • hydrofluorocarbon
  • organohalogen compound
  • aryl halide
  • phenylpropane
  • aromatic homomonocyclic compound
  • fluorobenzene
  • cumene
  • hydrocarbon derivative
  • halobenzene