| SpectraBase Spectrum ID |
LOc4xgF4KUq |
| Name |
5,5-Dimethyl-3-(hexahydro-1(2H)-azocinyl)-2-cyclohexen-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
235.193614428 u |
| Formula |
C15H25NO |
| InChI |
InChI=1S/C15H25NO/c1-15(2)11-13(10-14(17)12-15)16-8-6-4-3-5-7-9-16/h10H,3-9,11-12H2,1-2H3 |
| InChIKey |
AKNSYQNKKKKRIX-UHFFFAOYSA-N |
| Molecular Weight |
235.371 g/mol |
| SMILES |
C1=C(CC(CC1=O)(C)C)N1CCCCCCC1 |
| Spectrum/Structure Validation Score (Raman) |
0.997437 |
