CHEBI:173203 - 2,5-Dimethylbenzaldehyde

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2,5-Dimethylbenzaldehyde
ChEBI ID CHEBI:173203
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H10O
Net Charge 0
Average Mass 134.178
Monoisotopic Mass 134.07316
InChI InChI=1S/C9H10O/c1-7-3-4-8(2)9(5-7)6-10/h3-6H,1-2H3
InChIKey SMUVABOERCFKRW-UHFFFAOYSA-N
SMILES O=CC1=C(C=CC(=C1)C)C
Metabolite of Species Details
Rattus norvegicus (NCBI:txid10116) Found in feces (BTO:0000440). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing 2,5-Dimethylbenzaldehyde (CHEBI:173203) is a carbonyl compound (CHEBI:36586)
IUPAC Name
2,5-dimethylbenzaldehyde
Manual Xref Database
21171509 ChemSpider
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Registry Number Type Source
5779-94-2 CAS Registry Number ChemIDplus