| SpectraBase Spectrum ID |
6JV8FVpg3sJ |
| Name |
Succinic acid, 2,2-dichloroethyl pentafluorobenzyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.979804981 u |
| Formula |
C13H9Cl2F5O4 |
| InChI |
InChI=1S/C13H9Cl2F5O4/c14-6(15)4-24-8(22)2-1-7(21)23-3-5-9(16)11(18)13(20)12(19)10(5)17/h6H,1-4H2 |
| InChIKey |
NSLMHBWLDXOZFX-UHFFFAOYSA-N |
| Molecular Weight |
395.109 g/mol |
| SMILES |
C(CC(OCC(Cl)Cl)=O)C(OCC1=C(C(=C(C(=C1F)F)F)F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850594 |
