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1,10-Diphenyl-11,13-dithiatetracyclo[8.2.1.0(2,9),0(3,8)]trideca-3,5,7-trien-12-one 13-oxide
SpectraBase Compound ID CkYsP5tHWu7
InChI InChI=1S/C23H16O2S2/c24-21-22(15-9-3-1-4-10-15)19-17-13-7-8-14-18(17)20(19)23(26-21,27(22)25)16-11-5-2-6-12-16/h1-14,19-20H/t19?,20?,22-,23+,27?/m0/s1
InChIKey DIUPGILYDGQTBH-JHNFVLTBSA-N
Mol Weight 388.5 g/mol
Molecular Formula C23H16O2S2
Exact Mass 388.059172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZQjjguVcXi
Name 1,10-Diphenyl-11,13-dithiatetracyclo[8.2.1.0(2,9),0(3,8)]trideca-3,5,7-trien-12-one 13-oxide
Alternate Name(s) 1,10-diphenyl-11,13-dithiatetracyclo[8.2.1.0(2,9).0(3,8)]trideca-3,5,7-trien-12-one 13-oxide
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Formula C23H16O2S2
InChI InChI=1S/C23H16O2S2/c24-21-22(15-9-3-1-4-10-15)19-17-13-7-8-14-18(17)20(19)23(26-21,27(22)25)16-11-5-2-6-12-16/h1-14,19-20H/t19?,20?,22-,23+,27?/m0/s1
InChIKey DIUPGILYDGQTBH-JHNFVLTBSA-N
Molecular Weight 388.499 g/mol
SMILES [C@@]12([S@]([C@](c3ccccc3)(C3C1c1c3cccc1)SC2=O)=O)c1ccccc1
SPLASH splash10-00di-0973000000-e9a0279ef110ee330ac1
Source of Spectrum KC-1993-1059-33
Wiley ID 777999