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1-(4'-Nitrophenyl)-3,4-bis[(triisopropylsilyl)ethynyl]-6-(trimethylsilyl)hex-3-ene-1,5-diyne
SpectraBase Compound ID BHknaehvOwP
InChI InChI=1S/C37H55NO2Si3/c1-28(2)42(29(3)4,30(5)6)26-23-35(19-16-34-17-20-37(21-18-34)38(39)40)36(22-25-41(13,14)15)24-27-43(31(7)8,32(9)10)33(11)12/h17-18,20-21,28-33H,1-15H3/b36-35+
InChIKey GPSBDBBQWBWMNP-ULDVOPSXSA-N
Mol Weight 630.1 g/mol
Molecular Formula C37H55NO2Si3
Exact Mass 629.35406 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EvOGh5vvRBn
Name 1-(4'-Nitrophenyl)-3,4-bis[(triisopropylsilyl)ethynyl]-6-(trimethylsilyl)hex-3-ene-1,5-diyne
Comments Less than 3 mono-isotopic peaks
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Formula C37H55NO2Si3
InChI InChI=1S/C37H55NO2Si3/c1-28(2)42(29(3)4,30(5)6)26-23-35(19-16-34-17-20-37(21-18-34)38(39)40)36(22-25-41(13,14)15)24-27-43(31(7)8,32(9)10)33(11)12/h17-18,20-21,28-33H,1-15H3/b36-35+
InChIKey GPSBDBBQWBWMNP-ULDVOPSXSA-N
Molecular Weight 630.107 g/mol
SMILES C(#C\C(C#C[Si](C)(C)C)=C\(C#C[Si](C(C)C)(C(C)C)C(C)C)C#Cc1ccc(N(=O)=O)cc1)[Si](C(C)C)(C(C)C)C(C)C
SPLASH splash10-00di-9000002000-fb49e88466b22bb047a6
Source of Spectrum H-79-2276-40
Synonyms triisopropyl{(3E)-3-[(4-nitrophenyl)ethynyl]-6-(triisopropylsilyl)-4-[(trimethylsilyl)ethynyl]-3-hexene-1,5-diynyl}silane
Wiley ID 1412058