SpectraBase Spectrum ID |
AGcAGdTIUn1 |
Name |
N-(4-Fluorophenyl)-3-phenyl-2-propenamide, N-trifluoroacetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
337.072591248 u |
Formula |
C17H11F4NO2 |
InChI |
InChI=1S/C17H11F4NO2/c18-13-7-9-14(10-8-13)22(16(24)17(19,20)21)15(23)11-6-12-4-2-1-3-5-12/h1-11H/b11-6+ |
InChIKey |
TUZIKSNFEVKZLE-IZZDOVSWSA-N |
Molecular Weight |
337.274 g/mol |
SMILES |
C1(F)=CC=C(C=C1)N(C(=O)\C=C\C1=CC=CC=C1)C(C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910085 |