Structure Information
Structure

Compound Identification

SMILES

CCC1(O)CC2CC(=O)OC2C1O

InChIKey

InChIKey=OGRVWFVCTSPZKH-UHFFFAOYSA-N

Formula

C9H14O4

Mass

186.207

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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

Tetrahydrofurans Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters 1,2-diols Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Gamma butyrolactone - Cyclic alcohol - Tetrahydrofuran - Tertiary alcohol - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Oxacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Alcohol - Organooxygen compound - Aliphatic heteropolycyclic 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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