| SpectraBase Spectrum ID |
4F3pFNDG2jn |
| Name |
Succinic acid, 2,4-dichlorophenethyl propyl 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/c1-2-8-20-14(18)5-6-15(19)21-9-7-11-3-4-12(16)10-13(11)17/h3-4,10H,2,5-9H2,1H3 |
| InChIKey |
OYSIYQYYGWQFLY-UHFFFAOYSA-N |
| Molecular Weight |
333.211 g/mol |
| SMILES |
C(CCC(OCCC1=CC=C(C=C1Cl)Cl)=O)(OCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954431 |
