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2-Cyano-3-mercapto-N-(4-methylphenyl)-3-phenylaminoacrylamide
SpectraBase Compound ID 1Bmn8u1A6TI
InChI InChI=1S/C17H15N3OS/c1-12-7-9-14(10-8-12)19-16(21)15(11-18)17(22)20-13-5-3-2-4-6-13/h2-10,20,22H,1H3,(H,19,21)/b17-15-
InChIKey UJRXYFFCTKMNBT-ICFOKQHNSA-N
Mol Weight 309.39 g/mol
Molecular Formula C17H15N3OS
Exact Mass 309.093583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9B21jATjGs5
Name 2-Cyano-3-mercapto-N-(4-methylphenyl)-3-phenylaminoacrylamide
Alternate Name(s) (Z)-3-anilino-2-cyano-3-mercapto-N-(4-methylphenyl)-2-propenamide (Z)-3-anilino-2-cyano-N-(4-methylphenyl)-3-sulfanylprop-2-enamide (Z)-3-anilino-2-cyano-N-(p-tolyl)-3-sulfanyl-prop-2-enamide (Z)-2-cyano-N-(4-methylphenyl)-3-phenylazanyl-3-sulfanyl-prop-2-enamide
Comments Less than 3 mono-isotopic peaks
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Formula C17H15N3OS
InChI InChI=1S/C17H15N3OS/c1-12-7-9-14(10-8-12)19-16(21)15(11-18)17(22)20-13-5-3-2-4-6-13/h2-10,20,22H,1H3,(H,19,21)/b17-15-
InChIKey UJRXYFFCTKMNBT-ICFOKQHNSA-N
Molecular Weight 309.387 g/mol
SMILES N(\C(=C\(C(Nc1ccc(cc1)C)=O)C#N)S)c1ccccc1
SPLASH splash10-0a4i-0901000000-48727ecbd0f8c45ba3cc
Source of Spectrum F2-47-383-2b
Wiley ID 1706179