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#23;(2S,3S,4A-R,5S,9S,18A-R)-5-(METHOXYMETHOXY)-2,3-BIS-(4-METHOXYPHENYL)-9-METHYL-2,3,4A,5,6,7,8,9,18,18A-DECAHYDRO-11H-[1,4]-DIOXINO-[2,3-H]-[2]-BENZO
SpectraBase Compound ID 6iJVQeeWFRL
InChI InChI=1S/C36H42O8/c1-24-9-7-13-31(41-23-38-2)35-32(14-8-11-25-10-5-6-12-30(25)36(37)42-24)43-33(26-15-19-28(39-3)20-16-26)34(44-35)27-17-21-29(40-4)22-18-27/h5-6,8,10-12,15-22,24,31-35H,7,9,13-14,23H2,1-4H3/b11-8+/t24-,31-,32+,33-,34-,35-/m0/s1
InChIKey KMZQLHUWEKLSOQ-OPNIPBOPSA-N
Mol Weight 602.7 g/mol
Molecular Formula C36H42O8
Exact Mass 602.287968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASNxMjX30Ob
Name #23;(2S,3S,4A-R,5S,9S,18A-R)-5-(METHOXYMETHOXY)-2,3-BIS-(4-METHOXYPHENYL)-9-METHYL-2,3,4A,5,6,7,8,9,18,18A-DECAHYDRO-11H-[1,4]-DIOXINO-[2,3-H]-[2]-BENZO
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H42O8
InChI InChI=1S/C36H42O8/c1-24-9-7-13-31(41-23-38-2)35-32(14-8-11-25-10-5-6-12-30(25)36(37)42-24)43-33(26-15-19-28(39-3)20-16-26)34(44-35)27-17-21-29(40-4)22-18-27/h5-6,8,10-12,15-22,24,31-35H,7,9,13-14,23H2,1-4H3/b11-8+/t24-,31-,32+,33-,34-,35-/m0/s1
InChIKey KMZQLHUWEKLSOQ-OPNIPBOPSA-N
Literature Reference Author A.S.KHARTULYARI,M.KAPUR,M.E.MAIER
Literature Reference Citation ORG.LETTERS,8,5833(2006)
Literature Reference DOI 10.1021/ol062479r
Molecular Weight 602.725 g/mol
Sample ID 39817
Solvent CDCl3