SpectraBase Spectrum ID |
JRbalNlYbdc |
Name |
5-Chloro-2-(2,2,2-trifluoroethoxy)aniline, N-acetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
267.027390721 u |
Formula |
C10H9ClF3NO2 |
InChI |
InChI=1S/C10H9ClF3NO2/c1-6(16)15-8-4-7(11)2-3-9(8)17-5-10(12,13)14/h2-4H,5H2,1H3,(H,15,16) |
InChIKey |
UQDGSHQNHIBROO-UHFFFAOYSA-N |
Molecular Weight |
267.635 g/mol |
SMILES |
C(F)(F)(F)COC1=C(C=C(C=C1)Cl)NC(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921818 |