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2-(4',5'-DIHYDROXY-6'-METHYLTETRAHYDRO-2'H-PYRAN-2'-YL)-1,5-DIMETHOXYANTHRAQUINONE
SpectraBase Compound ID DDCSZQ7zkRj
InChI InChI=1S/C22H22O7/c1-10-19(24)14(23)9-16(29-10)11-7-8-13-18(22(11)28-3)21(26)12-5-4-6-15(27-2)17(12)20(13)25/h4-8,10,14,16,19,23-24H,9H2,1-3H3/t10-,14-,16-,19-/m0/s1
InChIKey HIGHHJGBBMCOIY-IJAQBYFRSA-N
Mol Weight 398.41 g/mol
Molecular Formula C22H22O7
Exact Mass 398.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AgpETdZSRym
Name 2-(4',5'-DIHYDROXY-6'-METHYLTETRAHYDRO-2'H-PYRAN-2'-YL)-1,5-DIMETHOXYANTHRAQUINONE
Compound Number 32
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22O7
InChI InChI=1S/C22H22O7/c1-10-19(24)14(23)9-16(29-10)11-7-8-13-18(22(11)28-3)21(26)12-5-4-6-15(27-2)17(12)20(13)25/h4-8,10,14,16,19,23-24H,9H2,1-3H3/t10-,14-,16-,19-/m0/s1
InChIKey HIGHHJGBBMCOIY-IJAQBYFRSA-N
Literature Reference Author M.D.BERCICH,R.C.CAMBIE,P.S.RUTLEDGE
Literature Reference Citation AUSTR.J.CHEM.,52,303(1999)
Literature Reference DOI 10.1071/C98150
Molecular Weight 398.412 g/mol
Solvent CDCl3:CD3OD=1:1