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2,2,6,6-Tetrabenzylcyclohexanone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2,2,6,6-Tetrabenzylcyclohexanone
SpectraBase Compound ID 7NTQxu2LdE
InChI InChI=1S/C34H34O/c35-32-33(24-28-14-5-1-6-15-28,25-29-16-7-2-8-17-29)22-13-23-34(32,26-30-18-9-3-10-19-30)27-31-20-11-4-12-21-31/h1-12,14-21H,13,22-27H2
InChIKey ZCKDWJCGQRFMQW-UHFFFAOYSA-N
Mol Weight 458.6 g/mol
Molecular Formula C34H34O
Exact Mass 458.260966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 55FJgdCFq4
Name 2,2,6,6-Tetrabenzylcyclohexanone
CAS Registry Number 7382-13-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H34O
InChI InChI=1S/C34H34O/c35-32-33(24-28-14-5-1-6-15-28,25-29-16-7-2-8-17-29)22-13-23-34(32,26-30-18-9-3-10-19-30)27-31-20-11-4-12-21-31/h1-12,14-21H,13,22-27H2
InChIKey ZCKDWJCGQRFMQW-UHFFFAOYSA-N
Molecular Weight 458.645 g/mol
SMILES C1(C(C(Cc2ccccc2)(Cc2ccccc2)CCC1)=O)(Cc1ccccc1)Cc1ccccc1
SPLASH splash10-0006-9063000000-cdb95eb27e088ef609e9
Source of Spectrum J-45-1029-0
Wiley ID 1390121