CHEBI:183275 - 2-Propenoic acid, 2-methyl-, 3,3,5-trimethylcyclohexyl ester

ChEBI IDCHEBI:183275
ChEBI Name2-Propenoic acid, 2-methyl-, 3,3,5-trimethylcyclohexyl ester
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22O2
Net Charge0
Average Mass210.317
Monoisotopic Mass210.16198
SMILESC=C(C)C(=O)OC1CC(C)CC(C)(C)C1
InChIInChI=1S/C13H22O2/c1-9(2)12(14)15-11-6-10(3)7-13(4,5)8-11/h10-11H,1,6-8H2,2-5H3
InChIKeyDABQKEQFLJIRHU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS1866)
ChEBI Ontology
Outgoing Relation(s)
2-Propenoic acid, 2-methyl-, 3,3,5-trimethylcyclohexyl ester (CHEBI:183275) is a enoate ester (CHEBI:51702)
IUPAC Name 
(3,3,5-trimethylcyclohexyl) 2-methylprop-2-enoate
Manual XrefsDatabases
99676ChemSpider
Registry NumbersSources
CAS:7779-31-9ChemIDplus