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9,10,11,12-Tetraphenyl-2,6-dithiabicyclo[6.4.0]dodeca-8,10,12-triene
SpectraBase Compound ID FFm1JwpcNRE
InChI InChI=1S/C34H28S2/c1-5-14-25(15-6-1)30-29-24-35-22-13-23-36-34(29)33(28-20-11-4-12-21-28)32(27-18-9-3-10-19-27)31(30)26-16-7-2-8-17-26/h1-12,14-21H,13,22-24H2
InChIKey ZIPWMXTYSOIISH-UHFFFAOYSA-N
Mol Weight 500.7 g/mol
Molecular Formula C34H28S2
Exact Mass 500.163243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11eWg5v8LNi
Name 9,10,11,12-Tetraphenyl-2,6-dithiabicyclo[6.4.0]dodeca-8,10,12-triene
Alternate Name(s) 3,4-Didehydro-7,8,9,10-tetraphenyl-2H,6H-1,5-benzodithiocine 7,8,9,10-tetraphenyl-3,4-dihydro-2H,6H-1,5-benzodithiocin
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Formula C34H28S2
InChI InChI=1S/C34H28S2/c1-5-14-25(15-6-1)30-29-24-35-22-13-23-36-34(29)33(28-20-11-4-12-21-28)32(27-18-9-3-10-19-27)31(30)26-16-7-2-8-17-26/h1-12,14-21H,13,22-24H2
InChIKey ZIPWMXTYSOIISH-UHFFFAOYSA-N
Molecular Weight 500.718 g/mol
SMILES c12c(c(c(-c3ccccc3)c(c1-c1ccccc1)-c1ccccc1)-c1ccccc1)SCCCSC2
SPLASH splash10-0udi-0001290000-4b151e9b8ce26bbe5234
Source of Spectrum K-127-2040-24
Wiley ID 1399006