SpectraBase Spectrum ID |
FVKegidU7kY |
Name |
Benzamide, N-ethyl-N-(3-methylphenyl)-3-trifluoromethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
307.118398627 u |
Formula |
C17H16F3NO |
InChI |
InChI=1S/C17H16F3NO/c1-3-21(15-9-4-6-12(2)10-15)16(22)13-7-5-8-14(11-13)17(18,19)20/h4-11H,3H2,1-2H3 |
InChIKey |
PMWJHGOYRFZHOP-UHFFFAOYSA-N |
Molecular Weight |
307.316 g/mol |
SMILES |
C1(=CC=CC(=C1)C(N(CC)C1=CC=CC(=C1)C)=O)C(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837052 |