Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(O)(CC(C)=O)C1=CC(F)=CC=C1

InChIKey

InChIKey=LTLLKXBXHRQZIS-UHFFFAOYSA-N

Formula

C12H13FO4

Mass

240.23

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Keto acids and derivatives

Subclass

Gamma-keto acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Gamma-keto acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Gamma-keto acid - Fatty acid ester - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Beta-hydroxy ketone - Methyl ester - Tertiary alcohol - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Organohalogen compound - Organofluoride - Organooxygen compound - Carbonyl group - Aromatic alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as gamma-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C4 carbon atom.

External Descriptors

Not available

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