SpectraBase Spectrum ID |
BQjbFekQ310 |
Name |
4-Fluoro-2-trifluoromethyl-N-[1-[4-(trifluoromethyl)phenyl]ethylidene]aniline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
349.070146467 u |
Formula |
C16H10F7N |
InChI |
InChI=1S/C16H10F7N/c1-9(10-2-4-11(5-3-10)15(18,19)20)24-14-7-6-12(17)8-13(14)16(21,22)23/h2-8H,1H3/b24-9- |
InChIKey |
WBALKXUFORNZMW-OPVMPGTRSA-N |
Molecular Weight |
349.252 g/mol |
SMILES |
C=1(C(F)(F)F)C(\N=C/(C2=CC=C(C(F)(F)F)C=C2)C)=CC=C(C1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940377 |