| SpectraBase Spectrum ID |
8GT9jEED2DK |
| Name |
6,3'-Dimethoxy-3-hydroxyflavone, trifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
394.066422622 u |
| Formula |
C19H13F3O6 |
| InChI |
InChI=1S/C19H13F3O6/c1-25-11-5-3-4-10(8-11)16-17(28-18(24)19(20,21)22)15(23)13-9-12(26-2)6-7-14(13)27-16/h3-9H,1-2H3 |
| InChIKey |
DZVRCICWCJRLSZ-UHFFFAOYSA-N |
| Molecular Weight |
394.302 g/mol |
| SMILES |
C1=C(C=CC=C1OC)C1=C(OC(C(F)(F)F)=O)C(C2=CC(=CC=C2O1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857908 |
