| SpectraBase Spectrum ID |
JRO2iRHsWFQ |
| Name |
Succinic acid, 2,2-dichloroethyl 1-phenylpropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.058214456 u |
| Formula |
C15H18Cl2O4 |
| InChI |
InChI=1S/C15H18Cl2O4/c1-2-12(11-6-4-3-5-7-11)21-15(19)9-8-14(18)20-10-13(16)17/h3-7,12-13H,2,8-10H2,1H3 |
| InChIKey |
KQUHSOMAGSNQBG-UHFFFAOYSA-N |
| Molecular Weight |
333.211 g/mol |
| SMILES |
C(CC(OCC(Cl)Cl)=O)C(OC(CC)C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895962 |
