SpectraBase Spectrum ID |
37qCHmG3HXy |
Name |
2-Phenoxy-5-(trifluoromethyl)benzenamine, N-acetyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.082013117 u |
Formula |
C15H12F3NO2 |
InChI |
InChI=1S/C15H12F3NO2/c1-10(20)19-13-9-11(15(16,17)18)7-8-14(13)21-12-5-3-2-4-6-12/h2-9H,1H3,(H,19,20) |
InChIKey |
NVFADDJJVAWXGE-UHFFFAOYSA-N |
Molecular Weight |
295.261 g/mol |
SMILES |
C(NC=1C(OC2=CC=CC=C2)=CC=C(C(F)(F)F)C1)(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.869865 |