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1,4-Bis(5-bromo-3-butylthio-2-thienyl)benzene
SpectraBase Compound ID 3cz96RxNg26
InChI InChI=1S/C22H24Br2S4/c1-3-5-11-25-17-13-19(23)27-21(17)15-7-9-16(10-8-15)22-18(14-20(24)28-22)26-12-6-4-2/h7-10,13-14H,3-6,11-12H2,1-2H3
InChIKey KPUQQLHHPVNBCB-UHFFFAOYSA-N
Mol Weight 576.5 g/mol
Molecular Formula C22H24Br2S4
Exact Mass 573.912761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6VJOZ1T951K
Name 1,4-Bis(5-bromo-3-butylthio-2-thienyl)benzene
Alternate Name(s) 5-bromo-2-{4-[5-bromo-3-(butylsulfanyl)-2-thienyl]phenyl}-3-(butylsulfanyl)thiophene
Comments Less than 3 mono-isotopic peaks
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Formula C22H24Br2S4
InChI InChI=1S/C22H24Br2S4/c1-3-5-11-25-17-13-19(23)27-21(17)15-7-9-16(10-8-15)22-18(14-20(24)28-22)26-12-6-4-2/h7-10,13-14H,3-6,11-12H2,1-2H3
InChIKey KPUQQLHHPVNBCB-UHFFFAOYSA-N
Molecular Weight 576.482 g/mol
SMILES c1(ccc(cc1)-c1c(cc(s1)Br)SCCCC)-c1c(cc(s1)Br)SCCCC
SPLASH splash10-004i-0000090000-422744955152b1de3621
Source of Spectrum AJ-76-1457-5
Wiley ID 1577294