SpectraBase Spectrum ID |
H3lvRagiXfq |
Name |
6-Chloro-2',4'-difluorohexananilide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
261.073198100 u |
Formula |
C12H14ClF2NO |
InChI |
InChI=1S/C12H14ClF2NO/c13-7-3-1-2-4-12(17)16-11-6-5-9(14)8-10(11)15/h5-6,8H,1-4,7H2,(H,16,17) |
InChIKey |
SNIYTLAVFUXTBF-UHFFFAOYSA-N |
Molecular Weight |
261.700 g/mol |
SMILES |
N(C1=CC=C(C=C1F)F)C(CCCCCCl)=O |
Spectrum/Structure Validation Score (Raman) |
0.750452 |