SpectraBase Spectrum ID |
F7Yq57Zxl2y |
Name |
Methyl 4-methyl-2-(2-oxo-2-{[4-(trifluoromethyl)phenyl]amino}ethoxy)benzoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
367.103142484 u |
Formula |
C18H16F3NO4 |
InChI |
InChI=1S/C18H16F3NO4/c1-11-3-8-14(17(24)25-2)15(9-11)26-10-16(23)22-13-6-4-12(5-7-13)18(19,20)21/h3-9H,10H2,1-2H3,(H,22,23) |
InChIKey |
BCICUARDNFAYFX-UHFFFAOYSA-N |
Molecular Weight |
367.324 g/mol |
SMILES |
COC(=O)C=1C(OCC(NC2=CC=C(C=C2)C(F)(F)F)=O)=CC(C)=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915671 |