5,5-Dibutyl-4,5-dihydro-2(3H)furanone (CHEBI:171815)

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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	5,5-Dibutyl-4,5-dihydro-2(3H)furanone

ChEBI ID	CHEBI:171815

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C12H22O2

Net Charge

Average Mass

198.306

Monoisotopic Mass

198.16198

InChI

InChI=1S/C12H22O2/c1-3-5-8-12(9-6-4-2)10-7-11(13)14-12/h3-10H2,1-2H3

InChIKey

KZEKELDMLDBVFV-UHFFFAOYSA-N

SMILES

O1C(CCC1=O)(CCCC)CCCC

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606)	Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study

ChEBI Ontology
Outgoing	5,5-Dibutyl-4,5-dihydro-2(3H)furanone (CHEBI:171815) is a γ-lactone (CHEBI:37581)

IUPAC Name

5,5-dibutyloxolan-2-one

Registry Number	Type	Source
7774-47-2	CAS Registry Number	ChemIDplus