SpectraBase Spectrum ID |
1SkF3qsON0L |
Name |
Benzamide, N-(3-methylphenyl)-4-trifluoromethyl- |
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/c1-10-3-2-4-13(9-10)19-14(20)11-5-7-12(8-6-11)15(16,17)18/h2-9H,1H3,(H,19,20) |
InChIKey |
FFUHAMNWQGWTNB-UHFFFAOYSA-N |
Molecular Weight |
279.262 g/mol |
SMILES |
C1(=CC=C(C=C1)C(NC1=CC(C)=CC=C1)=O)C(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870799 |