BUTANE,3-4-EPI-THIO: 1-CYANO

Structure

2D structure of BUTANE,3-4-EPI-THIO: 1-CYANO
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 74196

Names and identifiers

Name

BUTANE,3-4-EPI-THIO: 1-CYANO

IUPAC name

octane-2,7-dione

SMILES

O=C(C)CCCCC(=O)C

General information

Molecular formula

C8H14O2

Molecular weight

142.20 g/mol

Monoisotopic mass

142.0994 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Arabidopsis thaliana (L.) Heynh. - -
Cole, R.A. (1975). 1-cyanoepithioalkanes: major products of alkenylglucosinolate hydrolysis in certain Cruciferae. Phytochemistry, 14, 2293-2294 doi:10.1016/s0031-9422(00)91120-8