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Ethyl 2-cyano-3-oxobutanoate
SpectraBase Compound ID KQXzftsOUx6
InChI InChI=1S/C7H9NO3/c1-3-11-7(10)6(4-8)5(2)9/h6H,3H2,1-2H3
InChIKey NWOKVFOTWMZMHL-UHFFFAOYSA-N
Mol Weight 155.15 g/mol
Molecular Formula C7H9NO3
Exact Mass 155.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NplMNOwrg4
Name Ethyl 2-cyano-3-oxobutanoate
CAS Registry Number 634-55-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9NO3
InChI InChI=1S/C7H9NO3/c1-3-11-7(10)6(4-8)5(2)9/h6H,3H2,1-2H3
InChIKey NWOKVFOTWMZMHL-UHFFFAOYSA-N
Molecular Weight 155.153 g/mol
SMILES C(C(=O)OCC)(C#N)C(=O)C
SPLASH splash10-0036-9000000000-4081d05f02c9243d6acb
Source of Spectrum EK-1999-988-0
Synonyms 2-cyano-3-keto-butyric acid ethyl ester 2-cyano-3-oxobutanoic acid ethyl ester Ethyl 2-cyanoacetoacetate Ethyl .alpha.-cyanoacetoacetate Ethyl 2-cyano-3-oxidanylidene-butanoate Ethyl 2-cyano-3-oxo-butanoate Ethyl a-cyanoacetoacetate
Wiley ID 1152675