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2-(3-hydroxy-4-methoxyphenethyl)-6,7-dimethoxy-4H-chromen-4-one
SpectraBase Compound ID Ba9gLsGZgXT
InChI InChI=1S/C20H20O6/c1-23-17-7-5-12(8-16(17)22)4-6-13-9-15(21)14-10-19(24-2)20(25-3)11-18(14)26-13/h5,7-11,22H,4,6H2,1-3H3
InChIKey VUTHNCVIDWOEJW-UHFFFAOYSA-N
Mol Weight 356.37 g/mol
Molecular Formula C20H20O6
Exact Mass 356.125988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 528wq6rkkTU
Name 2-(3-Hydroxy-4-methoxyphenethyl)-6,7-dimethoxy-4H-chromen-4-one
Comments Computed using HOSE algorithm
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Exact Mass 356.125988358 u
Formula C20H20O6
InChI InChI=1S/C20H20O6/c1-23-17-7-5-12(8-16(17)22)4-6-13-9-15(21)14-10-19(24-2)20(25-3)11-18(14)26-13/h5,7-11,22H,4,6H2,1-3H3
InChIKey VUTHNCVIDWOEJW-UHFFFAOYSA-N
Molecular Weight 356.374 g/mol
SMILES C=1(OC)C(=CC2=C(C1)OC(=CC2=O)CCC1=CC=C(OC)C(=C1)O)OC