Structure Information
Structure

Compound Identification

SMILES

CCCCCC[C@@H](C)OC(=O)C#C

InChIKey

InChIKey=RHHOLLNCXVFDIN-SNVBAGLBSA-N

Formula

C11H18O2

Mass

182.263

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Carboxylic acid derivatives

Intermediate Tree Nodes

Carboxylic acid esters - Alpha,beta-unsaturated carboxylic esters

Direct Parent

Ynoate esters

Alternative Parents

Molecular Framework

Aliphatic acyclic compounds

Substituents

Ynoate ester - Acetylide - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as ynoate esters. These are an alpha,beta-unsaturated carboxylic ester of general formula R1C#CC(=O)OR2 (R2= organyl compound) in which the ester C=O function is conjugated to a C#C double bond at the alpha,beta position.

External Descriptors

Not available

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