SpectraBase Spectrum ID |
3YFXyMh7uBo |
Name |
9-Benzyl-9-azabicyclo[3.3.1]nonan-3-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
229.146664235 u |
Formula |
C15H19NO |
InChI |
InChI=1S/C15H19NO/c17-15-9-13-7-4-8-14(10-15)16(13)11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2 |
InChIKey |
BVEFCNSLJKPSEA-UHFFFAOYSA-N |
Molecular Weight |
229.323 g/mol |
SMILES |
C12N(C(CCC2)CC(C1)=O)CC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967142 |