Structure Information
Structure

Compound Identification

SMILES

COC1=C(C)C(O)=C(C=C1)C(=O)CC(C)C(O)=O

InChIKey

InChIKey=ALSWWQQEBNRKML-UHFFFAOYSA-N

Formula

C13H16O5

Mass

252.266

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - Methoxyphenol - Phenoxy compound - Gamma-keto acid - Benzoyl - O-cresol - Phenol ether - Aryl alkyl ketone - Methoxybenzene - Anisole - Toluene - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Keto acid - Vinylogous acid - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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