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6-Acetoxy-1-hydroxy-2-methoxymethyl-8-methylanthraquinone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

6-Acetoxy-1-hydroxy-2-methoxymethyl-8-methylanthraquinone
SpectraBase Compound ID IWrUKErDQpO
InChI InChI=1S/C19H16O6/c1-9-6-12(25-10(2)20)7-14-15(9)19(23)16-13(18(14)22)5-4-11(8-24-3)17(16)21/h4-7,21H,8H2,1-3H3
InChIKey BLVKCKRFLGYDFL-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 7PtAxZmmaPM
Name 6-Acetoxy-1-hydroxy-2-methoxymethyl-8-methylanthraquinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.094688229 u
Formula C19H16O6
InChI InChI=1S/C19H16O6/c1-9-6-12(25-10(2)20)7-14-15(9)19(23)16-13(18(14)22)5-4-11(8-24-3)17(16)21/h4-7,21H,8H2,1-3H3
InChIKey BLVKCKRFLGYDFL-UHFFFAOYSA-N
Molecular Weight 340.331 g/mol
SMILES C=12C(C=3C(=CC(=CC3C(C2=CC=C(C1O)COC)=O)OC(=O)C)C)=O