BENZYL-2-METHYL-BUTYRATE

Structure

2D structure of BENZYL-2-METHYL-BUTYRATE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 91849

Names and identifiers

Name

BENZYL-2-METHYL-BUTYRATE

IUPAC name

benzyl 2-methylbutanoate

SMILES

CCC(C)C(=O)OCC1=CC=CC=C1

General information

Molecular formula

C12H16O2

Molecular weight

192.26 g/mol

Monoisotopic mass

192.1150 Da

Classification

Pathway:
-
Superclass:
-
Class:
-
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Artemisia annua L. leaf 10-360 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Mentha spicata L. essential oil -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Mentha spicata L. leaf -
Duke, J. A. Writeups or information summaries on approximately 2,000 economic plants, USDA, ARS, Beltsville, MD 20705.