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1,4-dibromo-2,5-bis(benzo[b]thiophen-2-yl)benzene
SpectraBase Compound ID DWcD9YUW4aa
InChI InChI=1S/C22H12Br2S2/c23-17-12-16(22-10-14-6-2-4-8-20(14)26-22)18(24)11-15(17)21-9-13-5-1-3-7-19(13)25-21/h1-12H
InChIKey SHYGXPZMXKNOIE-UHFFFAOYSA-N
Mol Weight 500.27 g/mol
Molecular Formula C22H12Br2S2
Exact Mass 497.874719 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KtjJesr9kqL
Name 1,4-dibromo-2,5-bis(benzo[b]thiophen-2-yl)benzene
Appearance Light yellow solid
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Formula C22H12Br2S2
InChI InChI=1S/C22H12Br2S2/c23-17-12-16(22-10-14-6-2-4-8-20(14)26-22)18(24)11-15(17)21-9-13-5-1-3-7-19(13)25-21/h1-12H
InChIKey SHYGXPZMXKNOIE-UHFFFAOYSA-N
Instrument Name Thermo Finnigan LTQ FT Ultra High Performance
Ionization Type EI
Literature Reference DOI 10.1002/anie.201908046
Molecular Weight 500.266 g/mol
Reported Formula C22H12Br2S2
SMILES c1(Br)cc(c(cc1-c1sc2ccccc2c1)Br)-c1cc2c(s1)cccc2
SPLASH splash10-0006-9100120000-4328aefb75940f5a6c90
Source of Spectrum ACI-58-SM15-2s
Wiley ID 1875604