SpectraBase Spectrum ID |
H6nD2aJ1f66 |
Name |
4-Trifluoromethoxy-3',5'-dichlorobenzophenone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
333.977519352 u |
Formula |
C14H7Cl2F3O2 |
InChI |
InChI=1S/C14H7Cl2F3O2/c15-10-5-9(6-11(16)7-10)13(20)8-1-3-12(4-2-8)21-14(17,18)19/h1-7H |
InChIKey |
LAEZEZAYKCQGCG-UHFFFAOYSA-N |
Molecular Weight |
335.109 g/mol |
SMILES |
C1(=CC=C(C=C1)C(=O)C1=CC(=CC(=C1)Cl)Cl)OC(F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.930435 |