SpectraBase Spectrum ID |
FWxSa945vKP |
Name |
N-[1-(2-Chlorophenyl)ethylidene]-2-(trifluoromethyl)aniline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
297.053211547 u |
Formula |
C15H11ClF3N |
InChI |
InChI=1S/C15H11ClF3N/c1-10(11-6-2-4-8-13(11)16)20-14-9-5-3-7-12(14)15(17,18)19/h2-9H,1H3/b20-10+ |
InChIKey |
MGJJOCWZCCQZFS-KEBDBYFISA-N |
Molecular Weight |
297.708 g/mol |
SMILES |
C(C=1C(\N=C\(C=2C(Cl)=CC=CC2)C)=CC=CC1)(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806181 |