For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Bis[(trimethylsilyl)ethynyl]-iptycene--(dibenzo / dinaphtho)
SpectraBase Compound ID zY01S1uRCE
InChI InChI=1S/C52H42Si2/c1-53(2,3)25-23-39-49-45-35-19-11-13-21-37(35)46(38-22-14-12-20-36(38)45)50(49)40(24-26-54(4,5)6)52-48-43-29-33-17-9-7-15-31(33)27-41(43)47(51(39)52)42-28-32-16-8-10-18-34(32)30-44(42)48/h7-22,27-30,45-48H,1-6H3/t45-,46+,47-,48+
InChIKey CGBKIYQBSNGNDO-JRRJZXJCSA-N
Mol Weight 723.1 g/mol
Molecular Formula C52H42Si2
Exact Mass 722.282504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID ATZGgbAXTOR
Name Bis[(trimethylsilyl)ethynyl]-iptycene--(dibenzo / dinaphtho)
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C52H42Si2
InChI InChI=1S/C52H42Si2/c1-53(2,3)25-23-39-49-45-35-19-11-13-21-37(35)46(38-22-14-12-20-36(38)45)50(49)40(24-26-54(4,5)6)52-48-43-29-33-17-9-7-15-31(33)27-41(43)47(51(39)52)42-28-32-16-8-10-18-34(32)30-44(42)48/h7-22,27-30,45-48H,1-6H3/t45-,46+,47-,48+
InChIKey CGBKIYQBSNGNDO-JRRJZXJCSA-N
Molecular Weight 723.078 g/mol
SMILES c12c(c(c3[C@]4(c5ccccc5[C@@](c3c1C#C[Si](C)(C)C)(c1ccccc41)[H])[H])C#C[Si](C)(C)C)[C@@]1(c3c([C@]2(c2c1cc1c(c2)cccc1)[H])cc1c(cccc1)c3)[H]
SPLASH splash10-00di-0000000900-610b881556478874efda
Source of Spectrum C-120-11872-15
Wiley ID 1699978