John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4my9sczdSW6 SpectraBase Spectrum ID=3mDfqvYrkKM

(accessed ).
ENT-13-EPOXYMETHYLISOOZATE-DIMER
SpectraBase Compound ID 4my9sczdSW6
InChI InChI=1S/2C42H64O5/c2*1-27(12-15-31-28(2)13-16-33-38(31,4)20-10-22-40(33,6)36(43)45-8)30-18-24-42(35(26-30)47-42)25-19-32-29(3)14-17-34-39(32,5)21-11-23-41(34,7)37(44)46-9/h2*30-35H,1-3,10-26H2,4-9H3/t30?,31-,32+,33+,34-,35?,38+,39-,40+,41-,42?;30?,31-,32-,33+,34+,35?,38+,39+,40+,41+,42?/m01/s1
InChIKey LJWLCRSPTPOLPP-WNRWGWLNSA-N
Mol Weight 1297.9 g/mol
Molecular Formula C84H128O10
Exact Mass 1296.950751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3mDfqvYrkKM
Name ENT-13-EPOXYMETHYLISOOZATE-DIMER
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C84H128O10
InChI InChI=1S/2C42H64O5/c2*1-27(12-15-31-28(2)13-16-33-38(31,4)20-10-22-40(33,6)36(43)45-8)30-18-24-42(35(26-30)47-42)25-19-32-29(3)14-17-34-39(32,5)21-11-23-41(34,7)37(44)46-9/h2*30-35H,1-3,10-26H2,4-9H3/t30?,31-,32+,33+,34-,35?,38+,39-,40+,41-,42?;30?,31-,32-,33+,34+,35?,38+,39+,40+,41+,42?/m01/s1
InChIKey LJWLCRSPTPOLPP-WNRWGWLNSA-N
Literature Reference Author D.MARTINS,L.HAMERSKI,S.A.V.ALVARENGA,N.F.ROQUE
Literature Reference Citation PHYTOCHEM.,51,813(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00097-7
Molecular Weight 1297.934 g/mol
Solvent CDCl3
Source File Reference UWUC7
SpectraBase Batch ID ATg7YPRVjsg