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CHEBI:171938 - 3-Cyclohexene-1-carboxaldehyde, 1,3,4-trimethyl-

Default Structure
ChEBI IDCHEBI:171938
ChEBI Name3-Cyclohexene-1-carboxaldehyde, 1,3,4-trimethyl-
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H16O
Net Charge0
Average Mass152.237
Monoisotopic Mass152.12012
SMILESCC1=C(C)CC(C)(C=O)CC1
InChIInChI=1S/C10H16O/c1-8-4-5-10(3,7-11)6-9(8)2/h7H,4-6H2,1-3H3
InChIKeyHPPUQZZCHCEJEW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
3-Cyclohexene-1-carboxaldehyde, 1,3,4-trimethyl- (CHEBI:171938) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
1,3,4-trimethylcyclohex-3-ene-1-carbaldehyde
Manual XrefsDatabases
35397ChemSpider
HMDB0059827HMDB
Registry NumbersSources
CAS:40702-26-9ChemIDplus