3-METHYL-BUTAN-2-ONE

Structure

2D structure of 3-METHYL-BUTAN-2-ONE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 11251

Names and identifiers

Name

3-METHYL-BUTAN-2-ONE

IUPAC name

3-methylbutan-2-one

SMILES

CC(C)C(=O)C

General information

Molecular formula

C5H10O

Molecular weight

86.13 g/mol

Monoisotopic mass

86.0732 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

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