| SpectraBase Spectrum ID |
BzafLvPaFA9 |
| Name |
Succinic acid, 2,2,3,3-tetrafluoropropyl 2,2,2-trichloroethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.950254518 u |
| Formula |
C9H9Cl3F4O4 |
| InChI |
InChI=1S/C9H9Cl3F4O4/c10-9(11,12)4-20-6(18)2-1-5(17)19-3-8(15,16)7(13)14/h7H,1-4H2 |
| InChIKey |
FVJAVKKTVABPCH-UHFFFAOYSA-N |
| Molecular Weight |
363.520 g/mol |
| SMILES |
C(CC(OCC(C(F)F)(F)F)=O)C(OCC(Cl)(Cl)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974385 |
