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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:132292 - 4-propoxy-2-butanone
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ChEBI Name
4-propoxy-2-butanone
ChEBI ID
CHEBI:132292
Definition
A ketone that is 4-hydroxy-2-butanone in which the hydroxy hydrogen has been replaced by a propyl group.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C7H14O2
Net Charge
0
Average Mass
130.185
Monoisotopic Mass
130.09938
InChI
InChI=1S/C7H14O2/c1-3-5-9-6-4-7(2)8/h3-6H2,1-2H3
InChIKey
CTGMQDUXYKIIBU-UHFFFAOYSA-N
SMILES
CCCOCCC(C)=O
Metabolite of Species
Details
Pseudomonas putida DOT-T1E
(NCBI:txid1196325)
See:
MetaboLights Study
ChEBI Ontology
Outgoing
4-propoxy-2-butanone (
CHEBI:132292
)
is a
ether (
CHEBI:25698
)
4-propoxy-2-butanone (
CHEBI:132292
)
is a
ketone (
CHEBI:17087
)
IUPAC Name
4-propoxybutan-2-one
Manual Xref
Database
468374
ChemSpider
View more database links
Registry Number
Type
Source
1744795
Reaxys Registry Number
Reaxys
Last Modified
12 January 2017