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Perphenyloctasilsesquioxane
SpectraBase Compound ID KT6CNHLY4j2
InChI InChI=1S/C48H40O12Si8/c1-9-25-41(26-10-1)61-49-62(42-27-11-2-12-28-42)52-65(45-33-17-5-18-34-45)54-63(50-61,43-29-13-3-14-30-43)56-67(47-37-21-7-22-38-47)57-64(51-61,44-31-15-4-16-32-44)55-66(53-62,46-35-19-6-20-36-46)59-68(58-65,60-67)48-39-23-8-24-40-48/h1-40H/t61-,62+,63-,64+,65+,66-,67+,68-
InChIKey KBXJHRABGYYAFC-AXOYDQAWSA-N
Mol Weight 1033.5 g/mol
Molecular Formula C48H40O12Si8
Exact Mass 1032.067389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HLYGEYz15oi
Name Perphenyloctasilsesquioxane
CAS Registry Number 5256-79-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H40O12Si8
InChI InChI=1S/C48H40O12Si8/c1-9-25-41(26-10-1)61-49-62(42-27-11-2-12-28-42)52-65(45-33-17-5-18-34-45)54-63(50-61,43-29-13-3-14-30-43)56-67(47-37-21-7-22-38-47)57-64(51-61,44-31-15-4-16-32-44)55-66(53-62,46-35-19-6-20-36-46)59-68(58-65,60-67)48-39-23-8-24-40-48/h1-40H/t61-,62+,63-,64+,65+,66-,67+,68-
InChIKey KBXJHRABGYYAFC-AXOYDQAWSA-N
Molecular Weight 1033.516 g/mol
SMILES c1ccc([Si@@]23O[Si@@]4(O[Si@]5(O[Si@]6(c7ccccc7)O[Si@@](c7ccccc7)(O[Si@](c7ccccc7)(O3)O[Si@@](O6)(c3ccccc3)O[Si@@](O5)(c3ccccc3)O2)O4)c2ccccc2)c2ccccc2)cc1
SPLASH splash10-0a59-7000000049-1ae0837861570969fe21
Source of Spectrum W5-1989-37344-28192
Synonyms Pentacyclo[9.5.1.13,9.15,15.17,13]octasiloxane, octaphenyl- Silsesquioxane, phenyl-, cubical octamer
Wiley ID 1418472