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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:51:06 UTC
Update Date2025-03-25 00:28:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02041002
Frequency0.6
Structure
Chemical FormulaC7H8FN
Molecular Mass125.0641
SMILESCc1cc(F)ccc1N
InChI KeyKMHLGVTVACLEJE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent fluorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl fluorides
  • hydrocarbon derivatives
  • organofluorides
  • organopnictogen compounds
  • primary amines
  • toluenes
    • Substituents
  • aryl fluoride
  • organofluoride
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • fluorobenzene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • toluene
  • amine