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Reference substances

IUPAC name:
2-cyanoethyl 3-oxobutanoate

Inventory

CAS number:
65193-87-5
Synonyms
Names:
Identifier:
CAS number
65193-87-5
Identifier:
IUPAC name
2-cyanoethyl 3-oxobutanoate
Identifier:
IUPAC name
2-cyanoethyl 3-oxobutanoate
Identifier:
other: Molecular formula
C7 H9 N O3
Identifier:
other: InChl
InChI=1/C7H9NO3/c1-6(9)5-7(10)11-4-2-3-8/h2,4-5H2,1H3
Identifier:
other: SMILES notation
O=C(CC(C)=O)OCCC#N
Butanoic acid, 3-oxo-, 2-cyanoethyl ester

Molecular and structural information

Molecular formula:
C7H9NO3
Molecular weight:
155.15
SMILES notation:
CC(=O)CC(=O)OCCC#N
InChl:
InChI=1S/C7H9NO3/c1-6(9)5-7(10)11-4-2-3-8/h2,4-5H2,1H3
Structural formula:
Chemical structure

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