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(7S)-9,9-DICHLORO-11-HYDROXY-7-[(1'R,2'R)-2'-HYDROXY-1'-METHYLPROPOXY]-7,8,9,10-TETRAHYDRO-NAPHTHACENE-5,12-DIONE
SpectraBase Compound ID 3Px2tebZs7n
InChI InChI=1S/C22H20Cl2O5/c1-10(25)11(2)29-17-9-22(23,24)8-16-14(17)7-15-18(21(16)28)20(27)13-6-4-3-5-12(13)19(15)26/h3-7,10-11,17,25,28H,8-9H2,1-2H3/t10-,11-,17+/m1/s1
InChIKey MSFXAYMWUSLJGJ-AGKHESDQSA-N
Mol Weight 435.3 g/mol
Molecular Formula C22H20Cl2O5
Exact Mass 434.068779 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CcZoSYL0AJL
Name (7S)-9,9-DICHLORO-11-HYDROXY-7-[(1'R,2'R)-2'-HYDROXY-1'-METHYLPROPOXY]-7,8,9,10-TETRAHYDRO-NAPHTHACENE-5,12-DIONE
Compound Number 32
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20Cl2O5
InChI InChI=1S/C22H20Cl2O5/c1-10(25)11(2)29-17-9-22(23,24)8-16-14(17)7-15-18(21(16)28)20(27)13-6-4-3-5-12(13)19(15)26/h3-7,10-11,17,25,28H,8-9H2,1-2H3/t10-,11-,17+/m1/s1
InChIKey MSFXAYMWUSLJGJ-AGKHESDQSA-N
Literature Reference Author R.C.CAMBIE,S.E.HOLROYD,D.S.LARSEN,P.S.RUTLEDGE,P.D.WOODGATE
Literature Reference Citation AUSTR.J.CHEM.,45,1589(1992)
Literature Reference DOI 10.1071/ch9921589
Molecular Weight 435.304 g/mol
Solvent CDCl3
Source File Reference UWTS2149