CHEBI:171953 - 4-Acetyl-1,4-dimethyl-1-cyclohexene

ChEBI IDCHEBI:171953
ChEBI Name4-Acetyl-1,4-dimethyl-1-cyclohexene
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H16O
Net Charge0
Average Mass152.237
Monoisotopic Mass152.12012
SMILESCC(=O)C1(C)CC=C(C)CC1
InChIInChI=1S/C10H16O/c1-8-4-6-10(3,7-5-8)9(2)11/h4H,5-7H2,1-3H3
InChIKeyBIUSXTISNNLMOR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
4-Acetyl-1,4-dimethyl-1-cyclohexene (CHEBI:171953) is a ketone (CHEBI:17087)
IUPAC Name 
1-(1,4-dimethylcyclohex-3-en-1-yl)ethanone
Manual XrefsDatabases
58780ChemSpider
HMDB0037024HMDB
Registry NumbersSources
CAS:43219-68-7ChemIDplus