| SpectraBase Spectrum ID |
DpP57bUGoq0 |
| Name |
2,4-Dimethoxy-4'-hydroxybenzophenone, heptafluorobutyrate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
454.065120655 u |
| Formula |
C19H13F7O5 |
| InChI |
InChI=1S/C19H13F7O5/c1-29-12-7-8-13(14(9-12)30-2)15(27)10-3-5-11(6-4-10)31-16(28)17(20,21)18(22,23)19(24,25)26/h3-9H,1-2H3 |
| InChIKey |
ANHKCASHYVBBAV-UHFFFAOYSA-N |
| Molecular Weight |
454.297 g/mol |
| SMILES |
COC1=C(C=CC(=C1)OC)C(=O)C1=CC=C(C=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94077 |
