SpectraBase Spectrum ID |
64s6PIVebmw |
Name |
2,4,5-Trifluoro-3-methoxybenzamide, N-(4-fluorophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
299.056941184 u |
Formula |
C14H9F4NO2 |
InChI |
InChI=1S/C14H9F4NO2/c1-21-13-11(17)9(6-10(16)12(13)18)14(20)19-8-4-2-7(15)3-5-8/h2-6H,1H3,(H,19,20) |
InChIKey |
ROMCVTXEZNFZIV-UHFFFAOYSA-N |
Molecular Weight |
299.225 g/mol |
SMILES |
C1(=CC=C(C=C1)NC(C1=C(C(=C(F)C(=C1)F)OC)F)=O)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91043 |