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3-cyano-2-butanone

PropertiesImage
MNX_IDMNXM150876 Image of MNXM150876
referencechebi:87599
formulaC5H7NO
global charge0
mol weight97.117
InChIKeyAMQCWPDDXYOEER-UHFFFAOYSA-N
InChIInChI=1S/C5H7NO/c1-4(3-6)5(2)7/h4H,1-2H3
SMILESCC(=O)C(C)C#N
MNX internals
InChI (mnx)InChI=1/C5H7NO/c1-4(3-6)5(2)7/h4H,1-2H3/t4? Image of MNXM150876
SMILES (mnx)[CH3:1][CH:4]([C:3]#[N:6])[C:5]([CH3:2])=[O:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:87599
chebi:87599
AMQCWPDDXYOEER-UHFFFAOYSA-N
3-cyano-2-butanone
2-methyl-3-keto-butyronitrile
2-methyl-3-oxobutanenitrile