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1-[2-[1-[2-(trimethylsilyl)ethynyl]-2-[2-(tert-butyldimethylsilyl)ethynyl]-4-tert-butylphenyl]ethynyl]-5-(tert-butyl)-3-[2-(diethylazido)phenylethynyl]benzene
SpectraBase Compound ID 1goJc95gnoI
InChI InChI=1S/C47H61N3Si2/c1-17-50(18-2)49-48-43-21-19-20-36(33-43)22-23-37-30-38(32-41(31-37)45(3,4)5)24-25-39-34-42(46(6,7)8)35-40(44(39)27-28-51(12,13)14)26-29-52(15,16)47(9,10)11/h19-21,30-35H,17-18H2,1-16H3
InChIKey SXZOEKOCXXWGPG-UHFFFAOYSA-N
Mol Weight 724.2 g/mol
Molecular Formula C47H61N3Si2
Exact Mass 723.440402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HhaqgMs2Cos
Name 1-[2-[1-[2-(trimethylsilyl)ethynyl]-2-[2-(tert-butyldimethylsilyl)ethynyl]-4-tert-butylphenyl]ethynyl]-5-(tert-butyl)-3-[2-(diethylazido)phenylethynyl]benzene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C47H61N3Si2
InChI InChI=1S/C47H61N3Si2/c1-17-50(18-2)49-48-43-21-19-20-36(33-43)22-23-37-30-38(32-41(31-37)45(3,4)5)24-25-39-34-42(46(6,7)8)35-40(44(39)27-28-51(12,13)14)26-29-52(15,16)47(9,10)11/h19-21,30-35H,17-18H2,1-16H3
InChIKey SXZOEKOCXXWGPG-UHFFFAOYSA-N
Molecular Weight 724.196 g/mol
SMILES C(c1c(C#C[Si](C(C)(C)C)(C)C)cc(cc1C#Cc1cc(C(C)(C)C)cc(C#Cc2cc(N=NN(CC)CC)ccc2)c1)C(C)(C)C)#C[Si](C)(C)C
SPLASH splash10-014i-0000090400-357fe12af023f9f2f3e8
Source of Spectrum C-117-10670-17
Synonyms (1E)-1-(3-{[3-tert-butyl-5-({5-tert-butyl-3-{[tert-butyl(dimethyl)silyl]ethynyl}-2-[(trimethylsilyl)ethynyl]phenyl}ethynyl)phenyl]ethynyl}phenyl)-3,3-diethyl-1-triazene
Wiley ID 759127