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6-Acetoxy-2-(t-butoxymethyl)-1-methoxy-8-methylanthraquinone
SpectraBase Compound ID 9KE2EKjVW63
InChI InChI=1S/C23H24O6/c1-12-9-15(29-13(2)24)10-17-18(12)21(26)19-16(20(17)25)8-7-14(22(19)27-6)11-28-23(3,4)5/h7-10H,11H2,1-6H3
InChIKey ZUDRQBAEBQDRMC-UHFFFAOYSA-N
Mol Weight 396.44 g/mol
Molecular Formula C23H24O6
Exact Mass 396.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8gUJvHFvFFB
Name 6-Acetoxy-2-(T-butoxymethyl)-1-methoxy-8-methylanthraquinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.157288487 u
Formula C23H24O6
InChI InChI=1S/C23H24O6/c1-12-9-15(29-13(2)24)10-17-18(12)21(26)19-16(20(17)25)8-7-14(22(19)27-6)11-28-23(3,4)5/h7-10H,11H2,1-6H3
InChIKey ZUDRQBAEBQDRMC-UHFFFAOYSA-N
Molecular Weight 396.439 g/mol
SMILES C=12C(C=3C(=CC(=CC3C(C2=CC=C(C1OC)COC(C)(C)C)=O)OC(=O)C)C)=O