| SpectraBase Spectrum ID |
CT98SvhsuuG |
| Name |
2,4-Dimethoxy-4'-hydroxybenzophenone, pentafluoropropionate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
404.068314329 u |
| Formula |
C18H13F5O5 |
| InChI |
InChI=1S/C18H13F5O5/c1-26-12-7-8-13(14(9-12)27-2)15(24)10-3-5-11(6-4-10)28-16(25)17(19,20)18(21,22)23/h3-9H,1-2H3 |
| InChIKey |
APESXVZBKCAQOC-UHFFFAOYSA-N |
| Molecular Weight |
404.289 g/mol |
| SMILES |
COC1=C(C=CC(=C1)OC)C(=O)C1=CC=C(C=C1)OC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944296 |
