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3,8-Dihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid, methyl ester, dimethyl ether

View entire compound with spectra: 1 NMR

3,8-Dihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid, methyl ester, dimethyl ether
SpectraBase Compound ID 3ACAs79aalf
InChI InChI=1S/C19H16O6/c1-9-14-11(8-13(24-3)15(9)19(22)25-4)17(20)10-6-5-7-12(23-2)16(10)18(14)21/h5-8H,1-4H3
InChIKey CRWVODHPRIMLFM-UHFFFAOYSA-N
Mol Weight 340.33 g/mol
Molecular Formula C19H16O6
Exact Mass 340.094688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ld2jvQVKa55
Name 3,8-Dihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid, methyl ester, dimethyl ether
Comments Computed using HOSE algorithm
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Exact Mass 340.094688229 u
Formula C19H16O6
InChI InChI=1S/C19H16O6/c1-9-14-11(8-13(24-3)15(9)19(22)25-4)17(20)10-6-5-7-12(23-2)16(10)18(14)21/h5-8H,1-4H3
InChIKey CRWVODHPRIMLFM-UHFFFAOYSA-N
Molecular Weight 340.331 g/mol
SMILES C1=CC(=C2C(C3=C(C(=C(C=C3C(C2=C1)=O)OC)C(=O)OC)C)=O)OC