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3-(4-Formylphenyl)-2-(phenylsulfonyl)acrylonitrile
SpectraBase Compound ID 1D9kJXEUB3B
InChI InChI=1S/C16H11NO3S/c17-11-16(10-13-6-8-14(12-18)9-7-13)21(19,20)15-4-2-1-3-5-15/h1-10,12H/b16-10+
InChIKey SJOLUYRUWDRCSV-MHWRWJLKSA-N
Mol Weight 297.33 g/mol
Molecular Formula C16H11NO3S
Exact Mass 297.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JwOuVAUUwCF
Name 3-(4-Formylphenyl)-2-(phenylsulfonyl)acrylonitrile
Alternate Name(s) (2E)-3-(4-Formylphenyl)-2-(phenylsulfonyl)-2-propenenitrile (E)-2-(benzenesulfonyl)-3-(4-formylphenyl)-2-propenenitrile (E)-2-(benzenesulfonyl)-3-(4-formylphenyl)prop-2-enenitrile (E)-2-besyl-3-(4-formylphenyl)acrylonitrile (E)-3-(4-methanoylphenyl)-2-(phenylsulfonyl)prop-2-enenitrile
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Formula C16H11NO3S
InChI InChI=1S/C16H11NO3S/c17-11-16(10-13-6-8-14(12-18)9-7-13)21(19,20)15-4-2-1-3-5-15/h1-10,12H/b16-10+
InChIKey SJOLUYRUWDRCSV-MHWRWJLKSA-N
Molecular Weight 297.328 g/mol
SMILES c1ccc(S(\C(=C\c2ccc(C=O)cc2)C#N)(=O)=O)cc1
SPLASH splash10-004j-9650000000-b0fd6a1c6d8d17d2c452
Source of Spectrum AD-0-2532-0
Wiley ID 1427339