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> Main
CHEBI:195514 - 1-cyclohexylethanone
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ChEBI Name
1-cyclohexylethanone
ChEBI ID
CHEBI:195514
Definition
A methyl ketone that is cyclohexane substituted by an acetyl group at position 1.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Elisabeth COUDERT
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Molfile
Formula
C8H14O
Net Charge
0
Average Mass
126.199
Monoisotopic Mass
126.10447
InChI
InChI=1S/C8H14O/c1-7(9)8-5-3-2-4-6-8/h8H,2-6H2,1H3
InChIKey
RIFKADJTWUGDOV-UHFFFAOYSA-N
SMILES
CC(=O)C1CCCCC1
ChEBI Ontology
Outgoing
1-cyclohexylethanone (
CHEBI:195514
)
is a
methyl ketone (
CHEBI:51867
)
IUPAC Name
1-cyclohexylethanone
Synonyms
Sources
1-acetylcyclohexane
NIST Chemistry WebBook
1-cyclohexylacetaldehyde
ChEBI
1-cyclohexylethan-1-one
IUPAC
1-cyclohexylethanone
UniProt
acetylcyclohexane
NIST Chemistry WebBook
cyclohexyl methyl ketone
NIST Chemistry WebBook
cyclohexylethanone
NIST Chemistry WebBook
hexahydroacetophenone
NIST Chemistry WebBook
methyl cyclohexyl ketone
NIST Chemistry WebBook
Registry Number
Type
Source
823-76-7
CAS Registry Number
NIST Chemistry WebBook
Citations
Types
Sources
18318476
PubMed citation
Europe PMC
20223063
PubMed citation
Europe PMC
22075635
PubMed citation
Europe PMC
22849715
PubMed citation
Europe PMC
34078803
PubMed citation
Europe PMC
34510929
PubMed citation
Europe PMC
Last Modified
15 August 2023