SpectraBase Spectrum ID |
13MwvN28NBJ |
Name |
N-(2,2-Difluoro-1-(4-fluorophenyl)ethylidene)-4-methoxyaniline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
279.087098498 u |
Formula |
C15H12F3NO |
InChI |
InChI=1S/C15H12F3NO/c1-20-13-8-6-12(7-9-13)19-14(15(17)18)10-2-4-11(16)5-3-10/h2-9,15H,1H3/b19-14- |
InChIKey |
WAMCTHYAPIJUNM-RGEXLXHISA-N |
Molecular Weight |
279.262 g/mol |
SMILES |
C1=C(C=CC(=C1)\C(C(F)F)=N\C1=CC=C(C=C1)OC)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903106 |