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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:48087 - but-1-yne
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ChEBI Ontology
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ChEBI Name
but-1-yne
ChEBI ID
CHEBI:48087
Definition
A terminal acetylenic compound that is butane carrying a triple bond at position 1.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C4H6
Net Charge
0
Average Mass
54.09044
Monoisotopic Mass
54.04695
InChI
InChI=1S/C4H6/c1-3-4-2/h1H,4H2,2H3
InChIKey
KDKYADYSIPSCCQ-UHFFFAOYSA-N
SMILES
CCC#C
ChEBI Ontology
Outgoing
but-1-yne (
CHEBI:48087
)
is a
alkyne (
CHEBI:22339
)
but-1-yne (
CHEBI:48087
)
is a
terminal acetylenic compound (
CHEBI:73477
)
Incoming
3-methyl-1-butyne (
CHEBI:87379
)
has parent hydride
but-1-yne (
CHEBI:48087
)
IUPAC Name
but-1-yne
Synonyms
Sources
1-butyne
ChemIDplus
ethyl acetylene
ChemIDplus
ethylacetylene
ChemIDplus
Registry Numbers
Types
Sources
107-00-6
CAS Registry Number
ChemIDplus
107-00-6
CAS Registry Number
NIST Chemistry WebBook
1304439
Beilstein Registry Number
Beilstein
Last Modified
07 August 2015