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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:25 UTC
Update Date2025-03-25 00:47:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02158903
Frequency0.5
Structure
Chemical FormulaC11H14N2
Molecular Mass174.1157
SMILESc1ccc2c(c1)NCC(C1CC1)N2
InChI KeyRCQKCEYEIPCPHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent secondary alkylarylamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • organopnictogen compounds
    • Substituents
  • azacycle
  • aromatic heteropolycyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organoheterocyclic compound
  • secondary aliphatic/aromatic amine