| SpectraBase Spectrum ID |
DKqJwLaZNE0 |
| Name |
Trans-N-cyclohexyl-2-phenylcyclopropanecarboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
243.162314299 u |
| Formula |
C16H21NO |
| InChI |
InChI=1S/C16H21NO/c18-16(17-13-9-5-2-6-10-13)15-11-14(15)12-7-3-1-4-8-12/h1,3-4,7-8,13-15H,2,5-6,9-11H2,(H,17,18)/t14-,15+/m0/s1 |
| InChIKey |
VSJGIFGDUPGZCZ-LSDHHAIUSA-N |
| Molecular Weight |
243.350 g/mol |
| SMILES |
N(C([C@]1([C@](C=2C=CC=CC2)(C1)[H])[H])=O)C1CCCCC1 |
| Spectrum/Structure Validation Score (Raman) |
0.992825 |
