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4,4-Dicyano-3-(2-furanyl)butanoic acid ethyl ester
SpectraBase Compound ID HV6wq3o3fOq
InChI InChI=1S/C12H12N2O3/c1-2-16-12(15)6-10(9(7-13)8-14)11-4-3-5-17-11/h3-5,9-10H,2,6H2,1H3
InChIKey KSAISRPGQWHQKU-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C12H12N2O3
Exact Mass 232.084792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oVKthmRSFb
Name 4,4-Dicyano-3-(2-furanyl)butanoic acid ethyl ester
Alternate Name(s) 4,4-Dicyano-3-(2-furyl)butyric acid ethyl ester Ethyl 4,4-dicyano-3-(2-furyl)butanoate Ethyl 4,4-dicyano-3-(furan-2-yl)butanoate
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Formula C12H12N2O3
InChI InChI=1S/C12H12N2O3/c1-2-16-12(15)6-10(9(7-13)8-14)11-4-3-5-17-11/h3-5,9-10H,2,6H2,1H3
InChIKey KSAISRPGQWHQKU-UHFFFAOYSA-N
Molecular Weight 232.239 g/mol
SMILES c1(C(C(C#N)C#N)CC(=O)OCC)occc1
SPLASH splash10-0002-2960000000-d43ea369f0e14d18eaed
Source of Spectrum F-53-2905-3
Wiley ID 800861