| SpectraBase Spectrum ID |
HDCglLoFikD |
| Name |
2-Benzoyl-3-o-tolylcyclohex-2-enone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.130679818 u |
| Formula |
C20H18O2 |
| InChI |
InChI=1S/C20H18O2/c1-14-8-5-6-11-16(14)17-12-7-13-18(21)19(17)20(22)15-9-3-2-4-10-15/h2-6,8-11H,7,12-13H2,1H3 |
| InChIKey |
CCBDJZXBQVEHFP-UHFFFAOYSA-N |
| Molecular Weight |
290.362 g/mol |
| SMILES |
C1(=C(C=2C(C)=CC=CC2)CCCC1=O)C(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956337 |
