Structure Information
Structure

Compound Identification

SMILES

COC1=C(Br)C(=O)[C@@]2(C)[C@@H]3C[C@@H](C=C3)[C@H]2C1=O

InChIKey

InChIKey=IPLREKWVSHYOQQ-SMWKGLLFSA-N

Formula

C13H13BrO3

Mass

297.148

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones

Direct Parent

Cyclohexenones

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Cyclohexenone - Alpha-haloketone - Vinylogous ester - Vinylogous halide - Bromoalkene - Haloalkene - Vinyl halide - Vinyl bromide - Organic oxide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.

External Descriptors

Not available

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