| SpectraBase Spectrum ID |
IU2fNUa9S9d |
| Name |
2-Hydroxybenzoic acid, 2,2,2-trifluoroethyl, tirfluoroacetate diester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.017027647 u |
| Formula |
C11H6F6O4 |
| InChI |
InChI=1S/C11H6F6O4/c12-10(13,14)5-20-8(18)6-3-1-2-4-7(6)21-9(19)11(15,16)17/h1-4H,5H2 |
| InChIKey |
CRRFLXGZIVVZES-UHFFFAOYSA-N |
| Molecular Weight |
316.155 g/mol |
| SMILES |
C1(=CC=CC=C1C(=O)OCC(F)(F)F)OC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.83452 |
