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1,3-Diphenyl-4,7-dihydro-4,7-methanobenzo[c]thiophene
SpectraBase Compound ID 1VGGcSfBUoy
InChI InChI=1S/C21H16S/c1-3-7-14(8-4-1)20-18-16-11-12-17(13-16)19(18)21(22-20)15-9-5-2-6-10-15/h1-12,16-17H,13H2
InChIKey MSYTUEMCWWREQO-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C21H16S
Exact Mass 300.097272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EJM9FsWxNYp
Name 1,3-Diphenyl-4,7-dihydro-4,7-methanobenzo[c]thiophene
Comments Less than 3 mono-isotopic peaks
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Formula C21H16S
InChI InChI=1S/C21H16S/c1-3-7-14(8-4-1)20-18-16-11-12-17(13-16)19(18)21(22-20)15-9-5-2-6-10-15/h1-12,16-17H,13H2
InChIKey MSYTUEMCWWREQO-UHFFFAOYSA-N
Molecular Weight 300.419 g/mol
SMILES c12c(c(-c3ccccc3)sc1-c1ccccc1)C1CC2C=C1
SPLASH splash10-0udi-0109000000-d7bdf596d5216204285d
Source of Spectrum AJ-66-2710-2
Synonyms 3,5-diphenyl-4-thiatricyclo[5.2.1.0(2,6)]deca-2,5,8-triene
Wiley ID 772295