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2,2-Diphenylcyclohexanone

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

2,2-Diphenylcyclohexanone
SpectraBase Compound ID 70icCjpe1im
InChI InChI=1S/C18H18O/c19-17-13-7-8-14-18(17,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2
InChIKey VVZQVFCTDWFOOD-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C18H18O
Exact Mass 250.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BMgERjnt5DG
Name 2,2-Diphenylcyclohexanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.135765199 u
Formula C18H18O
InChI InChI=1S/C18H18O/c19-17-13-7-8-14-18(17,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2
InChIKey VVZQVFCTDWFOOD-UHFFFAOYSA-N
Molecular Weight 250.341 g/mol
SMILES C1(=O)CCCCC1(C1=CC=CC=C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.911435