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4',6'-Dimethoxy-4-fluoro-2'-hydroxychalcone, trifluoroacetate

View entire compound with spectra: 1 NMR

4',6'-Dimethoxy-4-fluoro-2'-hydroxychalcone, trifluoroacetate
SpectraBase Compound ID Aaw0AejJJm
InChI InChI=1S/C19H14F4O5/c1-26-13-9-15(27-2)17(16(10-13)28-18(25)19(21,22)23)14(24)8-5-11-3-6-12(20)7-4-11/h3-10H,1-2H3/b8-5+
InChIKey JYJKJUBWOFUPTN-VMPITWQZSA-N
Mol Weight 398.31 g/mol
Molecular Formula C19H14F4O5
Exact Mass 398.077736 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A08m6EGsSzX
Name 4',6'-Dimethoxy-4-fluoro-2'-hydroxychalcone, trifluoroacetate
Comments Computed using HOSE algorithm
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Exact Mass 398.077736198 u
Formula C19H14F4O5
InChI InChI=1S/C19H14F4O5/c1-26-13-9-15(27-2)17(16(10-13)28-18(25)19(21,22)23)14(24)8-5-11-3-6-12(20)7-4-11/h3-10H,1-2H3/b8-5+
InChIKey JYJKJUBWOFUPTN-VMPITWQZSA-N
Molecular Weight 398.310 g/mol
SMILES C1(=C(C=C(C=C1OC(C(F)(F)F)=O)OC)OC)C(\C=C\C1=CC=C(C=C1)F)=O