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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:41 UTC
Update Date2025-03-25 00:49:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177817
Frequency0.5
Structure
Chemical FormulaC12H16FN
Molecular Mass193.1267
SMILESCNC1CCCC1c1ccc(F)cc1
InChI KeyKLPFTDBNWAMYGC-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
  • dialkylamines
  • hydrocarbon derivatives
  • organofluorides
  • organopnictogen compounds
    • Substituents
  • aryl fluoride
  • secondary aliphatic amine
  • organofluoride
  • secondary amine
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • fluorobenzene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine