| SpectraBase Spectrum ID |
EwLZvaEFusH |
| Name |
Diethyl 3,5-diphenyl-1-oxocyclohex-2-en-4,4-dicarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
392.162373868 u |
| Formula |
C24H24O5 |
| InChI |
InChI=1S/C24H24O5/c1-3-28-22(26)24(23(27)29-4-2)20(17-11-7-5-8-12-17)15-19(25)16-21(24)18-13-9-6-10-14-18/h5-15,21H,3-4,16H2,1-2H3 |
| InChIKey |
GDWHLLOKPRMORL-UHFFFAOYSA-N |
| Molecular Weight |
392.451 g/mol |
| SMILES |
C1(C=C(C(C(C1)C=1C=CC=CC1)(C(=O)OCC)C(=O)OCC)C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.841736 |
