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2-keto-6-phenyl-4-(1-phenyl-2-thioxo-3-pyridyl)-1H-pyridine-3-carbonitrile
SpectraBase Compound ID EhfItYmxwBY
InChI InChI=1S/C23H15N3OS/c24-15-20-19(14-21(25-22(20)27)16-8-3-1-4-9-16)18-12-7-13-26(23(18)28)17-10-5-2-6-11-17/h1-14H,(H,25,27)
InChIKey OPFOWLQIJLCPMT-UHFFFAOYSA-N
Mol Weight 381.45 g/mol
Molecular Formula C23H15N3OS
Exact Mass 381.093583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBHa9PSb7ZK
Name 2-keto-6-phenyl-4-(1-phenyl-2-thioxo-3-pyridyl)-1H-pyridine-3-carbonitrile
Alternate Name(s) 2-oxidanylidene-6-phenyl-4-(1-phenyl-2-sulfanylidene-pyridin-3-yl)-1H-pyridine-3-carbonitrile 2-oxo-6-phenyl-4-(1-phenyl-2-sulfanylidene-3-pyridinyl)-1H-pyridine-3-carbonitrile 2-oxo-6-phenyl-4-(1-phenyl-2-sulfanylidenepyridin-3-yl)-1H-pyridine-3-carbonitrile 2-oxo-6-phenyl-4-(1-phenyl-2-thioxo-3-pyridyl)-1H-pyridine-3-carbonitrile
CAS Registry Number 89818-05-3
Comments Less than 3 mono-isotopic peaks
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Formula C23H15N3OS
InChI InChI=1S/C23H15N3OS/c24-15-20-19(14-21(25-22(20)27)16-8-3-1-4-9-16)18-12-7-13-26(23(18)28)17-10-5-2-6-11-17/h1-14H,(H,25,27)
InChIKey OPFOWLQIJLCPMT-UHFFFAOYSA-N
Molecular Weight 381.453 g/mol
SMILES N1C(C(=C(C=C1c1ccccc1)C=1C(N(c2ccccc2)C=CC1)=S)C#N)=O
SPLASH splash10-001i-0009000000-1ced880588bc20d2950d
Source of Spectrum Y-20-1654-0
Wiley ID 1360237