For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3',4'-Dimethoxy-3-hydroxy-6-methylflavone, chlorodifluoroacetate

View entire compound with spectra: 1 NMR, and 1 FTIR

3',4'-Dimethoxy-3-hydroxy-6-methylflavone, chlorodifluoroacetate
SpectraBase Compound ID 4UqCHZ8Jorl
InChI InChI=1S/C20H15ClF2O6/c1-10-4-6-13-12(8-10)16(24)18(29-19(25)20(21,22)23)17(28-13)11-5-7-14(26-2)15(9-11)27-3/h4-9H,1-3H3
InChIKey CZOKKVLVDNREBZ-UHFFFAOYSA-N
Mol Weight 424.78 g/mol
Molecular Formula C20H15ClF2O6
Exact Mass 424.052522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3F7kvNBYvUR
Name 3',4'-Dimethoxy-3-hydroxy-6-methylflavone, chlorodifluoroacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.052522223 u
Formula C20H15ClF2O6
InChI InChI=1S/C20H15ClF2O6/c1-10-4-6-13-12(8-10)16(24)18(29-19(25)20(21,22)23)17(28-13)11-5-7-14(26-2)15(9-11)27-3/h4-9H,1-3H3
InChIKey CZOKKVLVDNREBZ-UHFFFAOYSA-N
Molecular Weight 424.784 g/mol
SMILES C1=C(C=CC(=C1OC)OC)C1=C(OC(C(F)(F)Cl)=O)C(C2=CC(=CC=C2O1)C)=O