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Showing information for DMID00239961

Record Information
HMDB Statusexpected
Creation Date2024-02-21 01:15:25 UTC
Update Date2025-03-21 19:08:34 UTC
HMDB IDHMDB0001382
Metabolite Identification
DeepMet IDDMID00239961
NameVaporole
Frequency8.8
Structure
Chemical FormulaC5H11NO2
Molecular Mass117.079
SMILESCC(C)CCON=O
InChI KeyOWFXIOWLTKNBAP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organic nitroso compounds
Direct Parent organic o-nitroso compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkyl nitrites
  • hydrocarbon derivatives
  • nitrite esters
  • organic nitrogen compounds
  • organic oxides
  • organooxygen compounds
    • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • nitrite ester
  • organic nitrite
  • organooxygen compound
  • organic o-nitroso compound
  • alkyl nitrite