| SpectraBase Spectrum ID |
34VjDNakWs |
| Name |
Succinic acid, 2,2-dichloroethyl 1-bromo-3,3,3-trifluoroprop-2-yl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
387.909161687 u |
| Formula |
C9H10BrCl2F3O4 |
| InChI |
InChI=1S/C9H10BrCl2F3O4/c10-3-5(9(13,14)15)19-8(17)2-1-7(16)18-4-6(11)12/h5-6H,1-4H2 |
| InChIKey |
XIOUTOGAFJPRCP-UHFFFAOYSA-N |
| Molecular Weight |
389.980 g/mol |
| SMILES |
C(CC(OCC(Cl)Cl)=O)C(OC(CBr)C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971033 |
