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1,4-Di[4-(3,5-bis-trimethylsilylethynylphenyl)ethynylphenyl]butadiyne

View entire compound with spectra: 1 MS (GC)

1,4-Di[4-(3,5-bis-trimethylsilylethynylphenyl)ethynylphenyl]butadiyne
SpectraBase Compound ID 6xShNXjCHEz
InChI InChI=1S/C52H50Si4/c1-53(2,3)33-29-49-37-47(38-50(41-49)30-34-54(4,5)6)27-25-45-21-17-43(18-22-45)15-13-14-16-44-19-23-46(24-20-44)26-28-48-39-51(31-35-55(7,8)9)42-52(40-48)32-36-56(10,11)12/h17-24,37-42H,1-12H3
InChIKey XRHOZSATHFUAOU-UHFFFAOYSA-N
Mol Weight 787.3 g/mol
Molecular Formula C52H50Si4
Exact Mass 786.298958 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7bzA8ubOlu
Name 1,4-Di[4-(3,5-bis-trimethylsilylethynylphenyl)ethynylphenyl]butadiyne
Alternate Name(s) ({3-[(4-{4-[4-({3,5-bis[(trimethylsilyl)ethynyl]phenyl}ethynyl)phenyl]-1,3-butadiynyl}phenyl)ethynyl]-5-[(trimethylsilyl)ethynyl]phenyl}ethynyl)(trimethyl)silane 2-[3-[2-[4-[4-[4-[2-[3,5-bis(2-trimethylsilylethynyl)phenyl]ethynyl]phenyl]buta-1,3-diynyl]phenyl]ethynyl]-5-(2-trimethylsilylethynyl)phenyl]ethynyl-trimethylsilane
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Formula C52H50Si4
InChI InChI=1S/C52H50Si4/c1-53(2,3)33-29-49-37-47(38-50(41-49)30-34-54(4,5)6)27-25-45-21-17-43(18-22-45)15-13-14-16-44-19-23-46(24-20-44)26-28-48-39-51(31-35-55(7,8)9)42-52(40-48)32-36-56(10,11)12/h17-24,37-42H,1-12H3
InChIKey XRHOZSATHFUAOU-UHFFFAOYSA-N
Molecular Weight 787.312 g/mol
SMILES C(#Cc1cc(C#C[Si](C)(C)C)cc(C#Cc2ccc(C#CC#Cc3ccc(C#Cc4cc(C#C[Si](C)(C)C)cc(C#C[Si](C)(C)C)c4)cc3)cc2)c1)[Si](C)(C)C
SPLASH splash10-000i-1001000900-d59d3a5a2d0653267c9c
Source of Spectrum F-68-8127-20
Wiley ID 1573525