| SpectraBase Spectrum ID |
MyigGGXDjF |
| Name |
Methyl 2-hydroxy-4-methoxybenzoate, o-pentafluoropropionyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.037014200 u |
| Formula |
C12H9F5O5 |
| InChI |
InChI=1S/C12H9F5O5/c1-20-6-3-4-7(9(18)21-2)8(5-6)22-10(19)11(13,14)12(15,16)17/h3-5H,1-2H3 |
| InChIKey |
ZATMWZCIBDRJDZ-UHFFFAOYSA-N |
| Molecular Weight |
328.191 g/mol |
| SMILES |
C1(=C(C=C(C=C1)OC)OC(C(C(F)(F)F)(F)F)=O)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.87354 |
