SpectraBase Spectrum ID |
F8mOAqGj9Uz |
Name |
N-(2-Fluoro-5-methylphenyl)benzamide, N-trifluoroacetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
325.072591248 u |
Formula |
C16H11F4NO2 |
InChI |
InChI=1S/C16H11F4NO2/c1-10-7-8-12(17)13(9-10)21(15(23)16(18,19)20)14(22)11-5-3-2-4-6-11/h2-9H,1H3 |
InChIKey |
NRSZBALASMSIKW-UHFFFAOYSA-N |
Molecular Weight |
325.263 g/mol |
SMILES |
C1(F)=C(C=C(C=C1)C)N(C(=O)C1=CC=CC=C1)C(C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817711 |