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1,3-Dihydroxy-1-(7-methoxy-2-oxo-2H-chromen-6-yl)-3-methylbutan-2-yl 3-methylbutanoate,
SpectraBase Compound ID KpronI9tXoF
InChI InChI=1S/C20H26O7/c1-11(2)8-17(22)27-19(20(3,4)24)18(23)13-9-12-6-7-16(21)26-14(12)10-15(13)25-5/h6-7,9-11,18-19,23-24H,8H2,1-5H3
InChIKey GMMHQFAVUZIMEL-UHFFFAOYSA-N
Mol Weight 378.42 g/mol
Molecular Formula C20H26O7
Exact Mass 378.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8TwN6I3jqf3
Name 1,3-Dihydroxy-1-(7-methoxy-2-oxo-2H-chromen-6-yl)-3-methylbutan-2-yl 3-methylbutanoate,
Comments Computed using HOSE algorithm
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Exact Mass 378.167853170 u
Formula C20H26O7
InChI InChI=1S/C20H26O7/c1-11(2)8-17(22)27-19(20(3,4)24)18(23)13-9-12-6-7-16(21)26-14(12)10-15(13)25-5/h6-7,9-11,18-19,23-24H,8H2,1-5H3
InChIKey GMMHQFAVUZIMEL-UHFFFAOYSA-N
Molecular Weight 378.421 g/mol
SMILES C(CC(C)C)(=O)OC(C(O)(C)C)C(C1=C(C=C2OC(C=CC2=C1)=O)OC)O