ClassyFire

Compound Identification

SMILES

CC(C)(O)C#CC=O

InChIKey

InChIKey=DENGJZSRGVDRDY-UHFFFAOYSA-N

Formula

C6H8O2

Mass

112.128

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Carbonyl compounds
      - Level 5 Alpha,beta-unsaturated carbonyl compounds
        
        Level 6 Alpha,beta-unsaturated ketones
        
        Level 7 Ynones

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Alpha,beta-unsaturated carbonyl compounds - Alpha,beta-unsaturated ketones

Direct Parent

Ynones

Alternative Parents

Ynals Tertiary alcohols Organic oxides Hydrocarbon derivatives Aldehydes

Molecular Framework

Aliphatic acyclic compounds

Substituents

Ynone - Ynal - Tertiary alcohol - Alpha,beta-unsaturated aldehyde - Organic oxide - Hydrocarbon derivative - Aldehyde - Alcohol - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as ynones. These are organic compounds containing the ynone functional group, an alpha,beta unsaturated ketone group with the general structure RC#C-C(=O)R' (R' not H).

External Descriptors

Not available

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