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3-Hydroxy-7,8,4'-trimethoxyflavone, chlorodifluoroacetate

View entire compound with spectra: 1 NMR

3-Hydroxy-7,8,4'-trimethoxyflavone, chlorodifluoroacetate
SpectraBase Compound ID Gou02V5KgSI
InChI InChI=1S/C20H15ClF2O7/c1-26-11-6-4-10(5-7-11)15-18(30-19(25)20(21,22)23)14(24)12-8-9-13(27-2)17(28-3)16(12)29-15/h4-9H,1-3H3
InChIKey IRDBXDKMAORNOR-UHFFFAOYSA-N
Mol Weight 440.78 g/mol
Molecular Formula C20H15ClF2O7
Exact Mass 440.047437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7vrGmzvNWON
Name 3-Hydroxy-7,8,4'-trimethoxyflavone, chlorodifluoroacetate
Comments Computed using HOSE algorithm
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Exact Mass 440.047436842 u
Formula C20H15ClF2O7
InChI InChI=1S/C20H15ClF2O7/c1-26-11-6-4-10(5-7-11)15-18(30-19(25)20(21,22)23)14(24)12-8-9-13(27-2)17(28-3)16(12)29-15/h4-9H,1-3H3
InChIKey IRDBXDKMAORNOR-UHFFFAOYSA-N
Molecular Weight 440.783 g/mol
SMILES C1=C(C=CC(=C1)OC)C1=C(OC(C(F)(F)Cl)=O)C(C2=CC=C(C(=C2O1)OC)OC)=O