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1-[4-(2-iodophenyl)-1,3-butadiynyl]-2-(triisopropylsilylethynyl)benzene
SpectraBase Compound ID KvndtUTBPie
InChI InChI=1S/C27H29ISi/c1-21(2)29(22(3)4,23(5)6)20-19-25-15-8-7-13-24(25)14-9-10-16-26-17-11-12-18-27(26)28/h7-8,11-13,15,17-18,21-23H,1-6H3
InChIKey WESGNTQHXHNZGC-UHFFFAOYSA-N
Mol Weight 508.52 g/mol
Molecular Formula C27H29ISi
Exact Mass 508.108322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2snGrjihOq
Name 1-[4-(2-iodophenyl)-1,3-butadiynyl]-2-(triisopropylsilylethynyl)benzene
Comments Less than 3 mono-isotopic peaks
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Formula C27H29ISi
InChI InChI=1S/C27H29ISi/c1-21(2)29(22(3)4,23(5)6)20-19-25-15-8-7-13-24(25)14-9-10-16-26-17-11-12-18-27(26)28/h7-8,11-13,15,17-18,21-23H,1-6H3
InChIKey WESGNTQHXHNZGC-UHFFFAOYSA-N
Molecular Weight 508.518 g/mol
SMILES c1(c(cccc1)C#C[Si](C(C)C)(C(C)C)C(C)C)C#CC#Cc1c(cccc1)I
SPLASH splash10-066r-0000960000-2d920af798c287cbbf15
Source of Spectrum KC-57-3518-22
Synonyms ({2-[4-(2-iodophenyl)-1,3-butadiynyl]phenyl}ethynyl)(triisopropyl)silane
Wiley ID 1623863