SpectraBase Spectrum ID |
Kh75dY55g8v |
Name |
2,6-Difluoro-3-methylbenzamide, N-(3-chloro-4-fluorophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
299.032476102 u |
Formula |
C14H9ClF3NO |
InChI |
InChI=1S/C14H9ClF3NO/c1-7-2-4-11(17)12(13(7)18)14(20)19-8-3-5-10(16)9(15)6-8/h2-6H,1H3,(H,19,20) |
InChIKey |
PLFZIWCDIKVLHR-UHFFFAOYSA-N |
Molecular Weight |
299.680 g/mol |
SMILES |
C1(=CC=C(C=C1Cl)NC(C1=C(C(=CC=C1F)C)F)=O)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919865 |