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4-(Tert-butyl)-6-phenyl-1-azabicyclo[4.3.1]decan-10-one

View entire compound with spectra: 1 FTIR

4-(Tert-butyl)-6-phenyl-1-azabicyclo[4.3.1]decan-10-one
SpectraBase Compound ID 4fQ0fjtu9BJ
InChI InChI=1S/C19H27NO/c1-18(2,3)16-10-13-20-12-7-11-19(14-16,17(20)21)15-8-5-4-6-9-15/h4-6,8-9,16H,7,10-14H2,1-3H3
InChIKey KNERKOQPEPERNV-UHFFFAOYSA-N
Mol Weight 285.43 g/mol
Molecular Formula C19H27NO
Exact Mass 285.209264 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6uQGy8Fpdpt
Name 4-(Tert-butyl)-6-phenyl-1-azabicyclo[4.3.1]decan-10-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 285.209264492 u
Formula C19H27NO
InChI InChI=1S/C19H27NO/c1-18(2,3)16-10-13-20-12-7-11-19(14-16,17(20)21)15-8-5-4-6-9-15/h4-6,8-9,16H,7,10-14H2,1-3H3
InChIKey KNERKOQPEPERNV-UHFFFAOYSA-N
SMILES C1N2C(C(CC(C1)C(C)(C)C)(CCC2)C1=CC=CC=C1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.871196