SpectraBase Spectrum ID |
8PtnGaFq13d |
Name |
Benzamide, 4-trifluoromethyl-N-benzyl-N-isobutyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
335.149698756 u |
Formula |
C19H20F3NO |
InChI |
InChI=1S/C19H20F3NO/c1-14(2)12-23(13-15-6-4-3-5-7-15)18(24)16-8-10-17(11-9-16)19(20,21)22/h3-11,14H,12-13H2,1-2H3 |
InChIKey |
SHXJEOPUZFHZFR-UHFFFAOYSA-N |
Molecular Weight |
335.370 g/mol |
SMILES |
C1=CC(=CC=C1C(N(CC(C)C)CC1=CC=CC=C1)=O)C(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.880918 |