BENZOIC-ACID-ETHYL-ESTER

Structure

2D structure of BENZOIC-ACID-ETHYL-ESTER
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 18686

Names and identifiers

Name

BENZOIC-ACID-ETHYL-ESTER

IUPAC name

ethyl cyclohexanecarboxylate

SMILES

O=C(OCC)C1CCCCC1

General information

Molecular formula

C9H16O2

Molecular weight

156.23 g/mol

Monoisotopic mass

156.1150 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Sambucus nigra L. leaf, essential oil -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Trifolium pratense L. subsp. pratense root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.