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5-methyl-4-{[(8-methyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]methyl}-2-furoic acid

View entire compound with spectra: 2 NMR

5-methyl-4-{[(8-methyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]methyl}-2-furoic acid
SpectraBase Compound ID R4CLB1pv0b
InChI InChI=1S/C23H18O6/c1-13-19(27-12-16-10-20(23(25)26)28-14(16)2)9-8-17-18(11-21(24)29-22(13)17)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,25,26)
InChIKey XQJGEJVSJJJWJI-UHFFFAOYSA-N
Mol Weight 390.39 g/mol
Molecular Formula C23H18O6
Exact Mass 390.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9EkenHseOEB
Name 5-Methyl-4-{[(8-methyl-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]methyl}-2-furoic acid
Comments Computed using HOSE algorithm
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Exact Mass 390.110338294 u
Formula C23H18O6
InChI InChI=1S/C23H18O6/c1-13-19(27-12-16-10-20(23(25)26)28-14(16)2)9-8-17-18(11-21(24)29-22(13)17)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,25,26)
InChIKey XQJGEJVSJJJWJI-UHFFFAOYSA-N
Molecular Weight 390.391 g/mol
SMILES OC(C1=CC(COC=2C(=C3C(C(C=4C=CC=CC4)=CC(O3)=O)=CC2)C)=C(O1)C)=O