3,5,5-TRIMETHYLCYCLOHEXA-1,4-DIONE

Structure

2D structure of 3,5,5-TRIMETHYLCYCLOHEXA-1,4-DIONE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 30181

Names and identifiers

Name

3,5,5-TRIMETHYLCYCLOHEXA-1,4-DIONE

IUPAC name

2,2,6-trimethylcyclohexane-1,4-dione

SMILES

C1(CC(C(C(C1)(C)C)=O)C)=O

General information

Molecular formula

C9H14O2

Molecular weight

154.21 g/mol

Monoisotopic mass

154.0994 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Crocus vernus (L.) Hill flower -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.