| SpectraBase Spectrum ID |
HEoJP3YIDjX |
| Name |
Ethylene glycol monosalicylate, bis(trifluoroacetate) |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
374.022506950 u |
| Formula |
C13H8F6O6 |
| InChI |
InChI=1S/C13H8F6O6/c14-12(15,16)10(21)24-6-5-23-9(20)7-3-1-2-4-8(7)25-11(22)13(17,18)19/h1-4H,5-6H2 |
| InChIKey |
GWVFRUISTYOCTK-UHFFFAOYSA-N |
| Molecular Weight |
374.191 g/mol |
| SMILES |
C1=CC=C(C(=C1)C(=O)OCCOC(C(F)(F)F)=O)OC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91918 |
