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2,4-Diphenyl-3-azabicyclo[3.3.1]nonan-9-one

View entire compound with spectra: 1 FTIR

2,4-Diphenyl-3-azabicyclo[3.3.1]nonan-9-one
SpectraBase Compound ID AtA9C3Hruxk
InChI InChI=1S/C20H21NO/c22-18-12-16-11-17(13-18)20(15-9-5-2-6-10-15)21-19(16)14-7-3-1-4-8-14/h1-10,16-17,19-21H,11-13H2
InChIKey VFKCNWLTJOYZEE-UHFFFAOYSA-N
Mol Weight 291.39 g/mol
Molecular Formula C20H21NO
Exact Mass 291.162314 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HxfsSAQKki3
Name 2,4-Diphenyl-3-azabicyclo[3.3.1]nonan-9-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.162314299 u
Formula C20H21NO
InChI InChI=1S/C20H21NO/c22-18-12-16-11-17(13-18)20(15-9-5-2-6-10-15)21-19(16)14-7-3-1-4-8-14/h1-10,16-17,19-21H,11-13H2
InChIKey VFKCNWLTJOYZEE-UHFFFAOYSA-N
SMILES C1(NC(C2CC(CC1C2)=O)C1=CC=CC=C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.966817