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1,4-Di{4-[(3,5-bis-trimethylsilylethynylphenyl)ethynylphenyl]ethynylphenyl}butadiyne
SpectraBase Compound ID 3bAgzgqgOtR
InChI InChI=1S/C68H58Si4/c1-69(2,3)45-41-65-49-63(50-66(53-65)42-46-70(4,5)6)39-37-61-33-29-59(30-34-61)27-25-57-21-17-55(18-22-57)15-13-14-16-56-19-23-58(24-20-56)26-28-60-31-35-62(36-32-60)38-40-64-51-67(43-47-71(7,8)9)54-68(52-64)44-48-72(10,11)12/h17-24,29-36,49-54H,1-12H3
InChIKey DJADUJHYVLYDKH-UHFFFAOYSA-N
Mol Weight 987.6 g/mol
Molecular Formula C68H58Si4
Exact Mass 986.361558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZnwrpUwbjh
Name 1,4-Di{4-[(3,5-bis-trimethylsilylethynylphenyl)ethynylphenyl]ethynylphenyl}butadiyne
Alternate Name(s) [2-(3-{2-[4-(2-{4-[4-(4-{2-[4-(2-{3,5-bis[2-(trimethylsilyl)ethynyl]phenyl}ethynyl)phenyl]ethynyl}phenyl)buta-1,3-diyn-1-yl]phenyl}ethynyl)phenyl]ethynyl}-5-[2-(trimethylsilyl)ethynyl]phenyl)ethynyl]trimethylsilane 2-[3-[2-[4-[2-[4-[4-[4-[2-[4-[2-[3,5-bis(2-trimethylsilylethynyl)phenyl]ethynyl]phenyl]ethynyl]phenyl]buta-1,3-diynyl]phenyl]ethynyl]phenyl]ethynyl]-5-(2-trimethylsilylethynyl)phenyl]ethynyl-trimethylsilane
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Formula C68H58Si4
InChI InChI=1S/C68H58Si4/c1-69(2,3)45-41-65-49-63(50-66(53-65)42-46-70(4,5)6)39-37-61-33-29-59(30-34-61)27-25-57-21-17-55(18-22-57)15-13-14-16-56-19-23-58(24-20-56)26-28-60-31-35-62(36-32-60)38-40-64-51-67(43-47-71(7,8)9)54-68(52-64)44-48-72(10,11)12/h17-24,29-36,49-54H,1-12H3
InChIKey DJADUJHYVLYDKH-UHFFFAOYSA-N
Molecular Weight 987.552 g/mol
SMILES C(#Cc1cc(C#C[Si](C)(C)C)cc(C#Cc2ccc(C#Cc3ccc(C#CC#Cc4ccc(C#Cc5ccc(C#Cc6cc(C#C[Si](C)(C)C)cc(C#C[Si](C)(C)C)c6)cc5)cc4)cc3)cc2)c1)[Si](C)(C)C
SPLASH splash10-000i-1000100009-42dbf08bca301559040c
Source of Spectrum F-68-8127-21
Wiley ID 1573524