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4-(2''-CHLOROPROP-2''-ENYL-OXY)-2-[(4'R,5'R)-4',5'-DIMETHYL-1',3'-DIOXOLAN-2'-YL]-1-METHOXY-ANTHRAQUINONE
SpectraBase Compound ID FBrBjDbwJUj
InChI InChI=1S/C23H21ClO6/c1-11(24)10-28-17-9-16(23-29-12(2)13(3)30-23)22(27-4)19-18(17)20(25)14-7-5-6-8-15(14)21(19)26/h5-9,12-13,23H,1,10H2,2-4H3/t12-,13-/m1/s1
InChIKey AVDNPQQKMBPNJP-CHWSQXEVSA-N
Mol Weight 428.87 g/mol
Molecular Formula C23H21ClO6
Exact Mass 428.102666 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7scTbQNDBYe
Name 4-(2''-CHLOROPROP-2''-ENYL-OXY)-2-[(4'R,5'R)-4',5'-DIMETHYL-1',3'-DIOXOLAN-2'-YL]-1-METHOXY-ANTHRAQUINONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H21ClO6
InChI InChI=1S/C23H21ClO6/c1-11(24)10-28-17-9-16(23-29-12(2)13(3)30-23)22(27-4)19-18(17)20(25)14-7-5-6-8-15(14)21(19)26/h5-9,12-13,23H,1,10H2,2-4H3/t12-,13-/m1/s1
InChIKey AVDNPQQKMBPNJP-CHWSQXEVSA-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 428.869 g/mol
Solvent CDCl3
Source File Reference UWTS2136