| SpectraBase Spectrum ID |
50vhg4NZ2md |
| Name |
Diethyl 2,3-dibenzoylsuccinate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.141638422 u |
| Formula |
C22H22O6 |
| InChI |
InChI=1S/C22H22O6/c1-3-27-21(25)17(19(23)15-11-7-5-8-12-15)18(22(26)28-4-2)20(24)16-13-9-6-10-14-16/h5-14,17-18H,3-4H2,1-2H3 |
| InChIKey |
LNKDGSQQKJLYEV-UHFFFAOYSA-N |
| Molecular Weight |
382.412 g/mol |
| SMILES |
CCOC(C(C(C(OCC)=O)C(C1=CC=CC=C1)=O)C(=O)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.852703 |
