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1,4-Bis(5-bromo-3-dodecylthio-2-thienyl)benzene
SpectraBase Compound ID 8EF2vjA6kEA
InChI InChI=1S/C38H56Br2S4/c1-3-5-7-9-11-13-15-17-19-21-27-41-33-29-35(39)43-37(33)31-23-25-32(26-24-31)38-34(30-36(40)44-38)42-28-22-20-18-16-14-12-10-8-6-4-2/h23-26,29-30H,3-22,27-28H2,1-2H3
InChIKey QZHUZZBOFDOMMM-UHFFFAOYSA-N
Mol Weight 800.9 g/mol
Molecular Formula C38H56Br2S4
Exact Mass 798.163162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 73NsgCFQJOy
Name 1,4-Bis(5-bromo-3-dodecylthio-2-thienyl)benzene
Comments Less than 3 mono-isotopic peaks
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Formula C38H56Br2S4
InChI InChI=1S/C38H56Br2S4/c1-3-5-7-9-11-13-15-17-19-21-27-41-33-29-35(39)43-37(33)31-23-25-32(26-24-31)38-34(30-36(40)44-38)42-28-22-20-18-16-14-12-10-8-6-4-2/h23-26,29-30H,3-22,27-28H2,1-2H3
InChIKey QZHUZZBOFDOMMM-UHFFFAOYSA-N
Molecular Weight 800.914 g/mol
SMILES c1(ccc(cc1)-c1c(cc(s1)Br)SCCCCCCCCCCCC)-c1c(cc(s1)Br)SCCCCCCCCCCCC
SPLASH splash10-0udi-4000000290-db480a2c3465f7b03eb4
Source of Spectrum AJ-76-1457-5
Synonyms 5-bromo-2-{4-[5-bromo-3-(dodecylsulfanyl)-2-thienyl]phenyl}-3-(dodecylsulfanyl)thiophene
Wiley ID 1577291