| SpectraBase Spectrum ID |
4NRoG4daoMp |
| Name |
3,3,3-Trifluoro-2-hydroxy-2-phenyl-propionic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.050378636 u |
| Formula |
C10H9F3O3 |
| InChI |
InChI=1S/C10H9F3O3/c1-16-8(14)9(15,10(11,12)13)7-5-3-2-4-6-7/h2-6,15H,1H3 |
| InChIKey |
ZMXHAWAEEZLZQL-UHFFFAOYSA-N |
| Molecular Weight |
234.174 g/mol |
| SMILES |
C(C(F)(F)F)(C(=O)OC)(C1=CC=CC=C1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928767 |
