Geranyl 2-ethylbutyrate (CHEBI:196058)

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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	Geranyl 2-ethylbutyrate

ChEBI ID	CHEBI:196058

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H28O2

Net Charge

Average Mass

252.398

Monoisotopic Mass

252.20893

InChI

InChI=1S/C16H28O2/c1-6-15(7-2)16(17)18-12-11-14(5)10-8-9-13(3)4/h9,11,15H,6-8,10,12H2,1-5H3/b14-11+

InChIKey

PFVYLGTZGQUUOT-SDNWHVSQSA-N

SMILES

O(C(=O)C(CC)CC)C\C=C(\CCC=C(C)C)/C

ChEBI Ontology
Outgoing	Geranyl 2-ethylbutyrate (CHEBI:196058) is a carboxylic ester (CHEBI:33308)

IUPAC Name

[(2E)-3,7-dimethylocta-2,6-dienyl] 2-ethylbutanoate