| SpectraBase Spectrum ID |
35dl2hlnNZM |
| Name |
3-Hydroxy-6-methylflavone, chlorodifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
364.031392856 u |
| Formula |
C18H11ClF2O4 |
| InChI |
InChI=1S/C18H11ClF2O4/c1-10-7-8-13-12(9-10)14(22)16(25-17(23)18(19,20)21)15(24-13)11-5-3-2-4-6-11/h2-9H,1H3 |
| InChIKey |
RVOYSBNIDPCTOC-UHFFFAOYSA-N |
| Molecular Weight |
364.732 g/mol |
| SMILES |
C1=C(C=CC=C1)C1=C(OC(C(F)(F)Cl)=O)C(C2=CC(=CC=C2O1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935395 |
