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Perphenylcyclichexaethynylsilane
SpectraBase Compound ID 4n99Bugb2yT
InChI InChI=1S/C84H60Si6/c1-13-37-73(38-14-1)85(74-39-15-2-16-40-74)61-63-86(75-41-17-3-18-42-75,76-43-19-4-20-44-76)65-67-88(79-49-25-7-26-50-79,80-51-27-8-28-52-80)69-71-90(83-57-33-11-34-58-83,84-59-35-12-36-60-84)72-70-89(81-53-29-9-30-54-81,82-55-31-10-32-56-82)68-66-87(64-62-85,77-45-21-5-22-46-77)78-47-23-6-24-48-78/h1-60H
InChIKey KRZKYOXBSVRJFD-UHFFFAOYSA-N
Mol Weight 1237.9 g/mol
Molecular Formula C84H60Si6
Exact Mass 1236.331061 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1FfmmlgqME6
Name Perphenylcyclichexaethynylsilane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 1236.331061142 u
Formula C84H60Si6
InChI InChI=1S/C84H60Si6/c1-13-37-73(38-14-1)85(74-39-15-2-16-40-74)61-63-86(75-41-17-3-18-42-75,76-43-19-4-20-44-76)65-67-88(79-49-25-7-26-50-79,80-51-27-8-28-52-80)69-71-90(83-57-33-11-34-58-83,84-59-35-12-36-60-84)72-70-89(81-53-29-9-30-54-81,82-55-31-10-32-56-82)68-66-87(64-62-85,77-45-21-5-22-46-77)78-47-23-6-24-48-78/h1-60H
InChIKey KRZKYOXBSVRJFD-UHFFFAOYSA-N
Molecular Weight 1237.914 g/mol
SMILES C#1[Si](C#C[Si](C#C[Si](C#C[Si](C#C[Si](C#C[Si](C1)(C1=CC=CC=C1)C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1)(C=1C=CC=CC1)C1=CC=CC=C1