CITRONELLYL-ACETATE

Structure

2D structure of CITRONELLYL-ACETATE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 6708682

Names and identifiers

Name

CITRONELLYL-ACETATE

IUPAC name

(R)-3,7-dimethyloct-6-en-1-yl acetate

SMILES

O=C(OCC[C@@H](CC/C=C(\C)C)C)C

General information

Molecular formula

C12H22O2

Molecular weight

198.31 g/mol

Monoisotopic mass

198.1620 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Daucus carota L. seed 150-200 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.