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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:58:00 UTC
Update Date2025-03-21 18:05:31 UTC
HMDB IDHMDB0037266
Metabolite Identification
DeepMet IDDMID00057421
Name2,2,4-Trimethyl-1,3-dioxolane
Frequency55.2
Structure
Chemical FormulaC6H12O2
Molecular Mass116.0837
SMILESCC1COC(C)(C)O1
InChI KeyALTFLAPROMVXNX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • oxacycle
  • meta-dioxolane
  • ketal
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound