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3-Benzoyl-5-methyl-2-thioxo-1,4,6-triphenyl-1,2-dihydropyridine [3-benzoyl-5-methyl-1,4,6-triphenyl-2(1H)-pyridinethione]
SpectraBase Compound ID LZyODnrNh0g
InChI InChI=1S/C31H23NOS/c1-22-27(23-14-6-2-7-15-23)28(30(33)25-18-10-4-11-19-25)31(34)32(26-20-12-5-13-21-26)29(22)24-16-8-3-9-17-24/h2-21H,1H3
InChIKey BBSORWXRMCXJAI-UHFFFAOYSA-N
Mol Weight 457.59 g/mol
Molecular Formula C31H23NOS
Exact Mass 457.150036 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fP3BIqEXGr
Name 3-Benzoyl-5-methyl-2-thioxo-1,4,6-triphenyl-1,2-dihydropyridine [3-benzoyl-5-methyl-1,4,6-triphenyl-2(1H)-pyridinethione]
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Formula C31H23NOS
InChI InChI=1S/C31H23NOS/c1-22-27(23-14-6-2-7-15-23)28(30(33)25-18-10-4-11-19-25)31(34)32(26-20-12-5-13-21-26)29(22)24-16-8-3-9-17-24/h2-21H,1H3
InChIKey BBSORWXRMCXJAI-UHFFFAOYSA-N
Molecular Weight 457.591 g/mol
SMILES C=1(C(N(c2ccccc2)C(=C(C1c1ccccc1)C)c1ccccc1)=S)C(=O)c1ccccc1
SPLASH splash10-004i-1000900000-6f5c742f3a04b710a14f
Source of Spectrum SO-0-954-6
Wiley ID 1539033