| SpectraBase Spectrum ID |
17xA5S09bfa |
| Name |
5-Benzoyl-6-phenyl-3-p-tolyl-3, 4-dihydro-2H-pyran-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.141244501 u |
| Formula |
C25H20O3 |
| InChI |
InChI=1S/C25H20O3/c1-17-12-14-18(15-13-17)21-16-22(23(26)19-8-4-2-5-9-19)24(28-25(21)27)20-10-6-3-7-11-20/h2-15,21H,16H2,1H3 |
| InChIKey |
CXBRCEOGZYQMMS-UHFFFAOYSA-N |
| Molecular Weight |
368.432 g/mol |
| SMILES |
C1(C(CC(C(C2=CC=CC=C2)=O)=C(C2=CC=CC=C2)O1)C=1C=CC(C)=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.836838 |
