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4-Trimethylsilyl-3"'-bromo-1-[4-(4-phenyl-3,6-dihexylphenyl)phenyl]benzene trimer
SpectraBase Compound ID 4heBPvhjxnD
InChI InChI=1S/C111H129BrSi/c1-10-16-22-28-37-98-77-107(88-61-51-83(52-62-88)95-45-35-46-96(74-95)85-55-65-90(66-56-85)110-80-103(42-33-27-21-15-6)111(81-102(110)41-32-26-20-14-5)92-69-71-105(72-70-92)113(7,8)9)99(38-29-23-17-11-2)76-106(98)87-59-49-82(50-60-87)93-43-34-44-94(73-93)84-53-63-89(64-54-84)108-78-101(40-31-25-19-13-4)109(79-100(108)39-30-24-18-12-3)91-67-57-86(58-68-91)97-47-36-48-104(112)75-97/h34-36,43-81H,10-33,37-42H2,1-9H3
InChIKey QDLWCUADHDNUCA-UHFFFAOYSA-N
Mol Weight 1571.2 g/mol
Molecular Formula C111H129BrSi
Exact Mass 1568.904694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TfdlUE8F1q
Name 4-Trimethylsilyl-3"'-bromo-1-[4-(4-phenyl-3,6-dihexylphenyl)phenyl]benzene trimer
Comments Less than 3 mono-isotopic peaks
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Formula C111H129BrSi
InChI InChI=1S/C111H129BrSi/c1-10-16-22-28-37-98-77-107(88-61-51-83(52-62-88)95-45-35-46-96(74-95)85-55-65-90(66-56-85)110-80-103(42-33-27-21-15-6)111(81-102(110)41-32-26-20-14-5)92-69-71-105(72-70-92)113(7,8)9)99(38-29-23-17-11-2)76-106(98)87-59-49-82(50-60-87)93-43-34-44-94(73-93)84-53-63-89(64-54-84)108-78-101(40-31-25-19-13-4)109(79-100(108)39-30-24-18-12-3)91-67-57-86(58-68-91)97-47-36-48-104(112)75-97/h34-36,43-81H,10-33,37-42H2,1-9H3
InChIKey QDLWCUADHDNUCA-UHFFFAOYSA-N
Molecular Weight 1571.242 g/mol
SMILES c1(cc(CCCCCC)c(cc1CCCCCC)-c1ccc(-c2cc(Br)ccc2)cc1)-c1ccc(-c2cc(-c3ccc(-c4cc(CCCCCC)c(cc4CCCCCC)-c4ccc(-c5cc(-c6ccc(-c7cc(CCCCCC)c(cc7CCCCCC)-c7ccc([Si](C)(C)C)cc7)cc6)ccc5)cc4)cc3)ccc2)cc1
SPLASH splash10-00di-0000090000-c4216a3ccce8204ab05d
Source of Spectrum QE-5-427-9
Synonyms 4-Trimethylsilyl-3'''-bromo-1'''-[4-(4-phenyl-3,6-dihexylphenyl)phenyl]benzene trimer
Wiley ID 844074