3-METHYL-BUT-2-EN-1-AL

Structure

2D structure of 3-METHYL-BUT-2-EN-1-AL
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 61020

Names and identifiers

Name

3-METHYL-BUT-2-EN-1-AL

IUPAC name

3-methylbut-2-enal

SMILES

CC(C)=CC=O

General information

Molecular formula

C5H8O

Molecular weight

84.12 g/mol

Monoisotopic mass

84.0575 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.