Octanal propyleneglycol acetal (CHEBI:179386)

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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	Octanal propyleneglycol acetal

ChEBI ID	CHEBI:179386

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

Submitter	MetaboLights

Supplier Information

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Formula

C11H22O2

Net Charge

Average Mass

186.295

Monoisotopic Mass

186.16198

InChI

InChI=1S/C11H22O2/c1-3-4-5-6-7-8-11-12-9-10(2)13-11/h10-11H,3-9H2,1-2H3

InChIKey

PTJICCHLTNPHDB-UHFFFAOYSA-N

SMILES

O1C(OCC1C)CCCCCCC

ChEBI Ontology
Outgoing	Octanal propyleneglycol acetal (CHEBI:179386) is a dioxolane (CHEBI:39430)

IUPAC Name

2-heptyl-4-methyl-1,3-dioxolane

Registry Number	Type	Source
74094-61-4	CAS Registry Number	ChemIDplus