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#29;RAC-(5AR,6R,9R,9AS)-4-ACETYL-6-HYDROXY-1-METHOXY-9-(1-METHYLETHYL)-6-(PARA-TOSYLOXYMETHYL)-5A,6,7,8,9,9A-HEXAHYDRODIBENZOFURAN-3-YL-PARA-TOLUENESULFONATE

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#29;RAC-(5AR,6R,9R,9AS)-4-ACETYL-6-HYDROXY-1-METHOXY-9-(1-METHYLETHYL)-6-(PARA-TOSYLOXYMETHYL)-5A,6,7,8,9,9A-HEXAHYDRODIBENZOFURAN-3-YL-PARA-TOLUENESULFONATE
SpectraBase Compound ID HTlp15lzoQk
InChI InChI=1S/C33H38O10S2/c1-19(2)25-15-16-33(35,18-41-44(36,37)23-11-7-20(3)8-12-23)32-29(25)30-26(40-6)17-27(28(22(5)34)31(30)42-32)43-45(38,39)24-13-9-21(4)10-14-24/h7-14,17,19,25,29,32,35H,15-16,18H2,1-6H3/t25-,29+,32-,33+/m0/s1
InChIKey FWCVOITWCFGZDW-WXEINXRSSA-N
Mol Weight 658.8 g/mol
Molecular Formula C33H38O10S2
Exact Mass 658.19064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G1Nu6rlD1IG
Name #29;RAC-(5AR,6R,9R,9AS)-4-ACETYL-6-HYDROXY-1-METHOXY-9-(1-METHYLETHYL)-6-(PARA-TOSYLOXYMETHYL)-5A,6,7,8,9,9A-HEXAHYDRODIBENZOFURAN-3-YL-PARA-TOLUENESULFONATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H38O10S2
InChI InChI=1S/C33H38O10S2/c1-19(2)25-15-16-33(35,18-41-44(36,37)23-11-7-20(3)8-12-23)32-29(25)30-26(40-6)17-27(28(22(5)34)31(30)42-32)43-45(38,39)24-13-9-21(4)10-14-24/h7-14,17,19,25,29,32,35H,15-16,18H2,1-6H3/t25-,29+,32-,33+/m0/s1
InChIKey FWCVOITWCFGZDW-WXEINXRSSA-N
Literature Reference Author M.YAMASHITA,N.OHTA,T.SHIMIZU,K.MATSUMOTO,Y.MATSUURA,I.KAWASA KI,T.TANAKA,N.MAEZAK
Literature Reference Citation J.ORG.CHEM.,68,1216(2003)
Literature Reference DOI 10.1021/jo020619e
Molecular Weight 658.779 g/mol
Solvent CDCl3
Source File Reference UWSI22573