Structure Information
Structure

Compound Identification

SMILES

CC1CC(C#N)C(=O)O1

InChIKey

InChIKey=HEUVPDHMKYRCDO-UHFFFAOYSA-N

Formula

C6H7NO2

Mass

125.127

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactones

Subclass

Gamma butyrolactones

Intermediate Tree Nodes

Not available

Direct Parent

Gamma butyrolactones

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Gamma butyrolactone - Tetrahydrofuran - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Oxacycle - Nitrile - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as gamma butyrolactones. These are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom.

External Descriptors

Not available

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