| SpectraBase Spectrum ID |
GYcnoRXwPU0 |
| Name |
4-(4-Methyl-benzoyl)-3-phenyl-6-p-tolyl-pyran-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
380.141244501 u |
| Formula |
C26H20O3 |
| InChI |
InChI=1S/C26H20O3/c1-17-8-12-19(13-9-17)23-16-22(25(27)21-14-10-18(2)11-15-21)24(26(28)29-23)20-6-4-3-5-7-20/h3-16H,1-2H3 |
| InChIKey |
GAOQIJPCLDPKGW-UHFFFAOYSA-N |
| Molecular Weight |
380.443 g/mol |
| SMILES |
C1(=C(C(=O)OC(=C1)C=1C=CC(=CC1)C)C=1C=CC=CC1)C(C1=CC=C(C=C1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.82251 |
