SpectraBase Spectrum ID |
H9R0UtQghUn |
Name |
Benzamide, 4-trifluoromethyl-N-(2,4-dimethoxyphenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
325.092577801 u |
Formula |
C16H14F3NO3 |
InChI |
InChI=1S/C16H14F3NO3/c1-22-12-7-8-13(14(9-12)23-2)20-15(21)10-3-5-11(6-4-10)16(17,18)19/h3-9H,1-2H3,(H,20,21) |
InChIKey |
WRDUYFLJBGSGSG-UHFFFAOYSA-N |
Molecular Weight |
325.287 g/mol |
SMILES |
C1(=CC=C(C=C1)C(F)(F)F)C(NC=1C(OC)=CC(OC)=CC1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.892986 |