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3,4-Dimethoxy-2'-hydroxychalcone, trifluoroacetate

View entire compound with spectra: 1 NMR, and 1 FTIR

3,4-Dimethoxy-2'-hydroxychalcone, trifluoroacetate
SpectraBase Compound ID 2AfHnnZ4lmf
InChI InChI=1S/C19H15F3O5/c1-25-16-10-8-12(11-17(16)26-2)7-9-14(23)13-5-3-4-6-15(13)27-18(24)19(20,21)22/h3-11H,1-2H3/b9-7+
InChIKey OOSNOPPOGPDLRX-VQHVLOKHSA-N
Mol Weight 380.32 g/mol
Molecular Formula C19H15F3O5
Exact Mass 380.087158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7dBU74IffrF
Name 3,4-Dimethoxy-2'-hydroxychalcone, trifluoroacetate
Comments Computed using HOSE algorithm
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Exact Mass 380.087158067 u
Formula C19H15F3O5
InChI InChI=1S/C19H15F3O5/c1-25-16-10-8-12(11-17(16)26-2)7-9-14(23)13-5-3-4-6-15(13)27-18(24)19(20,21)22/h3-11H,1-2H3/b9-7+
InChIKey OOSNOPPOGPDLRX-VQHVLOKHSA-N
Molecular Weight 380.319 g/mol
SMILES C1(=CC=CC=C1OC(C(F)(F)F)=O)C(\C=C\C1=CC=C(C(=C1)OC)OC)=O