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Ethyl 2-(4-cyano-2-methylphenyl)-2,2-difluoroacetate
SpectraBase Compound ID JCLAFtIGrvj
InChI InChI=1S/C12H11F2NO2/c1-3-17-11(16)12(13,14)10-5-4-9(7-15)6-8(10)2/h4-6H,3H2,1-2H3
InChIKey YPBAFCPTVOGRGB-UHFFFAOYSA-N
Mol Weight 239.22 g/mol
Molecular Formula C12H11F2NO2
Exact Mass 239.075785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUNtvl7EcEK
Name Ethyl 2-(4-cyano-2-methylphenyl)-2,2-difluoroacetate
Alternate Name(s) 2-(4-cyano-2-methylphenyl)-2,2-difluoroacetic acid ethyl ester Ethyl 2-(4-cyano-2-methyl-phenyl)-2,2-difluoro-acetate Ethyl 2-(4-cyano-2-methyl-phenyl)-2,2-bis(fluoranyl)ethanoate
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Formula C12H11F2NO2
InChI InChI=1S/C12H11F2NO2/c1-3-17-11(16)12(13,14)10-5-4-9(7-15)6-8(10)2/h4-6H,3H2,1-2H3
InChIKey YPBAFCPTVOGRGB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201201040
Molecular Weight 239.222 g/mol
SMILES C(F)(c1ccc(C#N)cc1C)(F)C(OCC)=O
SPLASH splash10-014i-0910000000-a02d4c66f44e3cc773ed
Source of Spectrum ASC-355-996/SM10-4a
Wiley ID 1761977