| SpectraBase Spectrum ID |
A5u6RYzunCr |
| Name |
2,4-Dimethoxy-4'-hydroxybenzophenone, trifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.071508003 u |
| Formula |
C17H13F3O5 |
| InChI |
InChI=1S/C17H13F3O5/c1-23-12-7-8-13(14(9-12)24-2)15(21)10-3-5-11(6-4-10)25-16(22)17(18,19)20/h3-9H,1-2H3 |
| InChIKey |
HKCQWRJSYRAHAU-UHFFFAOYSA-N |
| Molecular Weight |
354.281 g/mol |
| SMILES |
COC1=C(C=CC(=C1)OC)C(=O)C1=CC=C(C=C1)OC(C(F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960227 |
