| SpectraBase Spectrum ID |
9amYxOhXurs |
| Name |
(Z)-Diethyl 2-benzylidenesuccinate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.120509056 u |
| Formula |
C15H18O4 |
| InChI |
InChI=1S/C15H18O4/c1-3-18-14(16)11-13(15(17)19-4-2)10-12-8-6-5-7-9-12/h5-10H,3-4,11H2,1-2H3/b13-10- |
| InChIKey |
KYFSKKXDQHJWKR-RAXLEYEMSA-N |
| Molecular Weight |
262.305 g/mol |
| SMILES |
C(\C(CC(=O)OCC)=C/C=1C=CC=CC1)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974509 |
