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Ethyl phenylcyanoacetate
SpectraBase Compound ID 3ra7aL5JqY4
InChI InChI=1S/C11H11NO2/c1-2-14-11(13)10(8-12)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
InChIKey SXIRJEDGTAKGKU-UHFFFAOYSA-N
Mol Weight 189.21 g/mol
Molecular Formula C11H11NO2
Exact Mass 189.078979 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgzGgGAJTdc
Name Benzeneacetic acid, .alpha.-cyano-, ethyl ester
Alternate Name(s) 2-cyano-2-phenyl-acetic acid ethyl ester Acetic acid, cyanophenyl-, ethyl ester Ethyl .alpha.-cyano-.alpha.-phenylacetate Ethyl .alpha.-cyanophenylacetate Ethyl 2-cyano-2-phenyl-acetate Ethyl 2-cyano-2-phenyl-ethanoate Ethyl cyano(phenyl)acetate Ethyl ester of .alpha.-cyanobenzeneacetic acid Phenylcyanoacetic acid ethyl ester 2-cyano-2-phenylacetic acid ethyl ester AI3-05831 EINECS 224-921-4
CAS Registry Number 4553-07-5
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Formula C11H11NO2
InChI InChI=1S/C11H11NO2/c1-2-14-11(13)10(8-12)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
InChIKey SXIRJEDGTAKGKU-UHFFFAOYSA-N
Molecular Weight 189.214 g/mol
SMILES C(C(C(=O)OCC)c1ccccc1)#N
SPLASH splash10-014i-7900000000-f1ca7ca14c98cbb89bd2
Source of Spectrum IC-433-0-0
Wiley ID 1185607