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3-(Trifluoroacetyl)oxy-2',4',5'-trimethoxyflavone

View entire compound with spectra: 1 NMR

3-(Trifluoroacetyl)oxy-2',4',5'-trimethoxyflavone
SpectraBase Compound ID WNtGPpmQkw
InChI InChI=1S/C20H15F3O7/c1-26-13-9-15(28-3)14(27-2)8-11(13)17-18(30-19(25)20(21,22)23)16(24)10-6-4-5-7-12(10)29-17/h4-9H,1-3H3
InChIKey WHULAWDOGOYZCV-UHFFFAOYSA-N
Mol Weight 424.33 g/mol
Molecular Formula C20H15F3O7
Exact Mass 424.076987 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C8E60YGpB7j
Name 3-(Trifluoroacetyl)oxy-2',4',5'-trimethoxyflavone
Comments Computed using HOSE algorithm
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Exact Mass 424.076987305 u
Formula C20H15F3O7
InChI InChI=1S/C20H15F3O7/c1-26-13-9-15(28-3)14(27-2)8-11(13)17-18(30-19(25)20(21,22)23)16(24)10-6-4-5-7-12(10)29-17/h4-9H,1-3H3
InChIKey WHULAWDOGOYZCV-UHFFFAOYSA-N
Molecular Weight 424.328 g/mol
SMILES C1(=C(C=C(C(=C1)OC)OC)C1=C(OC(=O)C(F)(F)F)C(C2=CC=CC=C2O1)=O)OC