| SpectraBase Spectrum ID |
IvY1qtdXg5r |
| Name |
Ethyl 2-benzamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
434.106511358 u |
| Formula |
C19H16F6N2O3 |
| InChI |
InChI=1S/C19H16F6N2O3/c1-2-30-16(29)17(19(23,24)25,27-15(28)12-6-4-3-5-7-12)26-14-10-8-13(9-11-14)18(20,21)22/h3-11,26H,2H2,1H3,(H,27,28) |
| InChIKey |
ADWSLPGZSWHECP-UHFFFAOYSA-N |
| Molecular Weight |
434.338 g/mol |
| SMILES |
C(NC1=CC=C(C(F)(F)F)C=C1)(NC(C=1C=CC=CC1)=O)(C(OCC)=O)C(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.8314 |
![Ethyl 2-benzamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate](/api/spectrum/IvY1qtdXg5r/structure.png?h=300&w=458 "Ethyl 2-benzamido-3,3,3-trifluoro-2-[4-(trifluoromethyl)anilino]propionate")
