| SpectraBase Spectrum ID |
KuWRGsPQ7HT |
| Name |
Acetic acid, (4-(trifluoromethoxy)phenyl)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/c1-7(14)15-6-8-2-4-9(5-3-8)16-10(11,12)13/h2-5H,6H2,1H3 |
| InChIKey |
LEOJDDUQYRSCSH-UHFFFAOYSA-N |
| Molecular Weight |
234.174 g/mol |
| SMILES |
C(OC1=CC=C(COC(=O)C)C=C1)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963072 |
