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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:06 UTC
Update Date2025-03-25 00:45:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151363
Frequency0.5
Structure
Chemical FormulaC10H10FN
Molecular Mass163.0797
SMILESFc1ccc(C2=NCCC2)cc1
InChI KeyRWAFNYAXDUXSKI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent fluorobenzenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl fluorides
  • azacyclic compounds
  • hydrocarbon derivatives
  • ketimines
  • organofluorides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
    • Substituents
  • aryl fluoride
  • ketimine
  • aromatic heteromonocyclic compound
  • azacycle
  • imine
  • organofluoride
  • organic 1,3-dipolar compound
  • organohalogen compound
  • aryl halide
  • propargyl-type 1,3-dipolar organic compound
  • fluorobenzene
  • pyrroline
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound