SpectraBase Spectrum ID |
KfLicXktwLO |
Name |
2-Hydroxy-5-chlorobenzophenone, trifluoroacetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
328.011406304 u |
Formula |
C15H8ClF3O3 |
InChI |
InChI=1S/C15H8ClF3O3/c16-10-6-7-12(22-14(21)15(17,18)19)11(8-10)13(20)9-4-2-1-3-5-9/h1-8H |
InChIKey |
ZNCQFFALIOANPN-UHFFFAOYSA-N |
Molecular Weight |
328.674 g/mol |
SMILES |
C1(Cl)=CC(=C(C=C1)OC(C(F)(F)F)=O)C(=O)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932036 |