| SpectraBase Spectrum ID |
KuSaDTSPRs3 |
| Name |
3-Anilino-5-phenyl-2-cyclohexen-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
263.131014170 u |
| Formula |
C18H17NO |
| InChI |
InChI=1S/C18H17NO/c20-18-12-15(14-7-3-1-4-8-14)11-17(13-18)19-16-9-5-2-6-10-16/h1-10,13,15,19H,11-12H2 |
| InChIKey |
TWQANWHARNYQGO-UHFFFAOYSA-N |
| Molecular Weight |
263.340 g/mol |
| SMILES |
N(C=1CC(C2=CC=CC=C2)CC(C1)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) |
0.968017 |