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5,6-bis(Trifluoroacetyl)oxyflavone
SpectraBase Compound ID AD4gDXZ8BkH
InChI InChI=1S/C19H8F6O6/c20-18(21,22)16(27)30-12-7-6-11-14(15(12)31-17(28)19(23,24)25)10(26)8-13(29-11)9-4-2-1-3-5-9/h1-8H
InChIKey FMGDBVKJPRMKAX-UHFFFAOYSA-N
Mol Weight 446.26 g/mol
Molecular Formula C19H8F6O6
Exact Mass 446.022507 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GUM9uOmiEUi
Name 5,6-bis(Trifluoroacetyl)oxyflavone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.022506950 u
Formula C19H8F6O6
InChI InChI=1S/C19H8F6O6/c20-18(21,22)16(27)30-12-7-6-11-14(15(12)31-17(28)19(23,24)25)10(26)8-13(29-11)9-4-2-1-3-5-9/h1-8H
InChIKey FMGDBVKJPRMKAX-UHFFFAOYSA-N
Molecular Weight 446.257 g/mol
SMILES C1=C(C=CC=C1)C1=CC(C2=C(C(=CC=C2O1)OC(C(F)(F)F)=O)OC(C(F)(F)F)=O)=O