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7,3'-Dimethoxy-3-hydroxyflavone, trifluoroacetate

View entire compound with spectra: 1 NMR

7,3'-Dimethoxy-3-hydroxyflavone, trifluoroacetate
SpectraBase Compound ID 8T8drG7ikng
InChI InChI=1S/C19H13F3O6/c1-25-11-5-3-4-10(8-11)16-17(28-18(24)19(20,21)22)15(23)13-7-6-12(26-2)9-14(13)27-16/h3-9H,1-2H3
InChIKey XIEHGJJTLSBHCX-UHFFFAOYSA-N
Mol Weight 394.3 g/mol
Molecular Formula C19H13F3O6
Exact Mass 394.066423 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AYEDp6qmiF1
Name 7,3'-Dimethoxy-3-hydroxyflavone, trifluoroacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.066422622 u
Formula C19H13F3O6
InChI InChI=1S/C19H13F3O6/c1-25-11-5-3-4-10(8-11)16-17(28-18(24)19(20,21)22)15(23)13-7-6-12(26-2)9-14(13)27-16/h3-9H,1-2H3
InChIKey XIEHGJJTLSBHCX-UHFFFAOYSA-N
Molecular Weight 394.302 g/mol
SMILES C1=C(C=CC=C1OC)C1=C(OC(C(F)(F)F)=O)C(C2=CC=C(C=C2O1)OC)=O