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Propennitrile, 2-(2-chlorophenylsulfonyl)-3-(4,6-dimethyl-2-pyrimidylamino)-
SpectraBase Compound ID 8s9iCo1Mjee
InChI InChI=1S/C15H13ClN4O2S/c1-10-7-11(2)20-15(19-10)18-9-12(8-17)23(21,22)14-6-4-3-5-13(14)16/h3-7,9H,1-2H3,(H,18,19,20)/b12-9+
InChIKey NUBADUZIZSVECA-FMIVXFBMSA-N
Mol Weight 348.81 g/mol
Molecular Formula C15H13ClN4O2S
Exact Mass 348.044775 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GlA173EcKJL
Name Propennitrile, 2-(2-chlorophenylsulfonyl)-3-(4,6-dimethyl-2-pyrimidylamino)-
Alternate Name(s) (2E)-2-[(2-Chlorophenyl)sulfonyl]-3-[(4,6-dimethyl-2-pyrimidinyl)amino]-2-propenenitrile (E)-2-(2-chlorophenyl)sulfonyl-3-[(4,6-dimethyl-2-pyrimidinyl)amino]-2-propenenitrile (E)-2-(2-chlorophenyl)sulfonyl-3-[(4,6-dimethylpyrimidin-2-yl)amino]acrylonitrile (E)-2-(2-chlorophenyl)sulfonyl-3-[(4,6-dimethylpyrimidin-2-yl)amino]prop-2-enenitrile
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Formula C15H13ClN4O2S
InChI InChI=1S/C15H13ClN4O2S/c1-10-7-11(2)20-15(19-10)18-9-12(8-17)23(21,22)14-6-4-3-5-13(14)16/h3-7,9H,1-2H3,(H,18,19,20)/b12-9+
InChIKey NUBADUZIZSVECA-FMIVXFBMSA-N
Molecular Weight 348.808 g/mol
SMILES N(c1nc(C)cc(n1)C)\C=C/(S(c1c(Cl)cccc1)(=O)=O)C#N
SPLASH splash10-00di-5900000000-b6a7e0c5904719debc3d
Source of Spectrum AD-0-2532-0
Wiley ID 1429123