3-Propyl-1,2-cyclopentanedione (CHEBI:195721)

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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	3-Propyl-1,2-cyclopentanedione

ChEBI ID	CHEBI:195721

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H12O2

Net Charge

Average Mass

140.182

Monoisotopic Mass

140.08373

InChI

InChI=1S/C8H12O2/c1-2-3-6-4-5-7(9)8(6)10/h6H,2-5H2,1H3

InChIKey

QBJXYRWUKSOXQY-UHFFFAOYSA-N

SMILES

O=C1C(CCC1=O)CCC

ChEBI Ontology
Outgoing	3-Propyl-1,2-cyclopentanedione (CHEBI:195721) is a cyclic ketone (CHEBI:3992)

IUPAC Name

3-propylcyclopentane-1,2-dione