SpectraBase Spectrum ID |
L5sWtIzuGmp |
Name |
Succinic acid, 2,2-dichloroethyl 1,1,1-trifluoroprop-2-yl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
309.998648719 u |
Formula |
C9H11Cl2F3O4 |
InChI |
InChI=1S/C9H11Cl2F3O4/c1-5(9(12,13)14)18-8(16)3-2-7(15)17-4-6(10)11/h5-6H,2-4H2,1H3 |
InChIKey |
MPEONHWHNJQRGO-UHFFFAOYSA-N |
Molecular Weight |
311.084 g/mol |
SMILES |
C(CC(OCC(Cl)Cl)=O)C(OC(C)C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.978053 |