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4,5-Diphenyl-1,4-thiazepone-3,7-dione
SpectraBase Compound ID JF2Z6aoUPjH
InChI InChI=1S/C18H15NO2S/c1-13-7-9-14(10-8-13)16-11-18(21)22-12-17(20)19(16)15-5-3-2-4-6-15/h2-11H,12H2,1H3
InChIKey UZLLUXPZPQNLBO-UHFFFAOYSA-N
Mol Weight 309.38 g/mol
Molecular Formula C18H15NO2S
Exact Mass 309.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24RUznFazwY
Name 4,5-Diphenyl-1,4-thiazepone-3,7-dione
Alternate Name(s) 4-Phenyl-5-p-tolyl-4H[1,4]thiazepone-3,7-dione 4-Phenyl-5-(p-tolyl)-1,4-thiazepine-3,7-dione 5-(4-Methylphenyl)-4-phenyl-1,4-thiazepine-3,7-dione
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Formula C18H15NO2S
InChI InChI=1S/C18H15NO2S/c1-13-7-9-14(10-8-13)16-11-18(21)22-12-17(20)19(16)15-5-3-2-4-6-15/h2-11H,12H2,1H3
InChIKey UZLLUXPZPQNLBO-UHFFFAOYSA-N
Molecular Weight 309.383 g/mol
SMILES C=1(N(C(CSC(C1)=O)=O)c1ccccc1)c1ccc(cc1)C
SPLASH splash10-014u-3920000000-4ca0b44e2b5f70f673bb
Source of Spectrum U-1996-214-4
Wiley ID 768003