EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:173203 - 2,5-Dimethylbenzaldehyde

Default Structure
ChEBI IDCHEBI:173203
ChEBI Name2,5-Dimethylbenzaldehyde
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H10O
Net Charge0
Average Mass134.178
Monoisotopic Mass134.07316
SMILESCc1ccc(C)c(C=O)c1
InChIInChI=1S/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H3
InChIKeySMUVABOERCFKRW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) feces (BTO:0000440) MetaboLights (MTBLS2721)
ChEBI Ontology
Outgoing Relation(s)
2,5-Dimethylbenzaldehyde (CHEBI:173203) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
2,5-dimethylbenzaldehyde
Manual XrefsDatabases
21171509ChemSpider
Registry NumbersSources
CAS:5779-94-2ChemIDplus