| SpectraBase Spectrum ID |
7Vfj5XZ8Omy |
| Name |
Methyl 2-hydroxy-4-methoxy-6-(trifluoromethyl)benzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.045293255 u |
| Formula |
C10H9F3O4 |
| InChI |
InChI=1S/C10H9F3O4/c1-16-5-3-6(10(11,12)13)8(7(14)4-5)9(15)17-2/h3-4,14H,1-2H3 |
| InChIKey |
JRUMDYHHDPJJCL-UHFFFAOYSA-N |
| Molecular Weight |
250.173 g/mol |
| SMILES |
C=1(C(C(F)(F)F)=CC(=CC1O)OC)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.951934 |
