| SpectraBase Spectrum ID |
9gbgqWoHy06 |
| Name |
Urea, N-(4-chlorophenyl)-N'-[4-(trifluoromethyl)phenyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.043375138 u |
| Formula |
C14H10ClF3N2O |
| InChI |
InChI=1S/C14H10ClF3N2O/c15-10-3-7-12(8-4-10)20-13(21)19-11-5-1-9(2-6-11)14(16,17)18/h1-8H,(H2,19,20,21) |
| InChIKey |
SRNBTVMPEGZWIW-UHFFFAOYSA-N |
| Molecular Weight |
314.695 g/mol |
| SMILES |
C(F)(F)(F)C1=CC=C(NC(=O)NC2=CC=C(C=C2)Cl)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954657 |