Structure Information
Structure

Compound Identification

SMILES

CN\C=C1\C(=O)CC(C)(C)OC1=O

InChIKey

InChIKey=NPNKYOQVOXRHME-WAYWQWQTSA-N

Formula

C9H13NO3

Mass

183.207

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Lactones

Subclass

Delta valerolactones

Intermediate Tree Nodes

Not available

Direct Parent

Delta valerolactones

Alternative Parents

Oxanes Vinylogous amides Enoate esters Cyclic ketones Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Enamines Dialkylamines Allylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Delta valerolactone - Delta_valerolactone - Oxane - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Carboxylic acid ester - Ketone - Cyclic ketone - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Allylamine - Monocarboxylic acid or derivatives - Secondary amine - Oxacycle - Organic oxide - Amine - Organopnictogen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aldehyde - Organic oxygen compound - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.

External Descriptors

Not available

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