| SpectraBase Spectrum ID |
BMahZxSvuyC |
| Name |
2,3,4-Trifluorobenzoic acid, 4-methoxyphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
282.050378636 u |
| Formula |
C14H9F3O3 |
| InChI |
InChI=1S/C14H9F3O3/c1-19-8-2-4-9(5-3-8)20-14(18)10-6-7-11(15)13(17)12(10)16/h2-7H,1H3 |
| InChIKey |
BUDRKSKGWADFOT-UHFFFAOYSA-N |
| Molecular Weight |
282.218 g/mol |
| SMILES |
C1=C(C(=C(C(=C1)C(OC1=CC=C(OC)C=C1)=O)F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.88392 |
