CHEBI:180432 - xi-2,2,6-Trimethyl-1,4-cyclohexanedione

ChEBI IDCHEBI:180432
ChEBI Namexi-2,2,6-Trimethyl-1,4-cyclohexanedione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H14O2
Net Charge0
Average Mass154.209
Monoisotopic Mass154.09938
SMILESCC1CC(=O)CC(C)(C)C1=O
InChIInChI=1S/C9H14O2/c1-6-4-7(10)5-9(2,3)8(6)11/h6H,4-5H2,1-3H3
InChIKeyHVHHZSFNAYSPSA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
xi-2,2,6-Trimethyl-1,4-cyclohexanedione (CHEBI:180432) is a cyclic ketone (CHEBI:3992)
IUPAC Name 
2,2,6-trimethylcyclohexane-1,4-dione
Manual XrefsDatabases
28029ChemSpider
HMDB0038697HMDB
Registry NumbersSources
CAS:20547-99-3ChemIDplus