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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:43:10 UTC
Update Date2025-03-21 17:59:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00022388
Frequency177.2
Structure
Chemical FormulaC6H17N2+
Molecular Mass117.1386
SMILESC[N+](C)(C)CCCN
InChI KeyPTTKEPPCFIOMEC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent tetraalkylammonium salts
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • hydrocarbon derivatives
  • monoalkylamines
  • organic cations
  • organic salts
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic cation
  • organic salt
  • amine