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ENT-13'-NOR-13'-OXOMETHYLISOOZATE-DIMER
SpectraBase Compound ID IWTW8r5hArt
InChI InChI=1S/C41H62O5/c1-27-11-21-34-38(3,23-9-25-40(34,5)36(43)45-7)31(27)18-15-29-13-16-30(17-14-29)33(42)20-19-32-28(2)12-22-35-39(32,4)24-10-26-41(35,6)37(44)46-8/h13,30-32,34-35H,1-2,9-12,14-26H2,3-8H3/t30?,31-,32-,34+,35+,38+,39+,40+,41+/m1/s1
InChIKey WQLFXXMSVDKBCS-PVYZTMILSA-N
Mol Weight 634.9 g/mol
Molecular Formula C41H62O5
Exact Mass 634.459725 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 25TusUYG6eb
Name ENT-13'-NOR-13'-OXOMETHYLISOOZATE-DIMER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H62O5
InChI InChI=1S/C41H62O5/c1-27-11-21-34-38(3,23-9-25-40(34,5)36(43)45-7)31(27)18-15-29-13-16-30(17-14-29)33(42)20-19-32-28(2)12-22-35-39(32,4)24-10-26-41(35,6)37(44)46-8/h13,30-32,34-35H,1-2,9-12,14-26H2,3-8H3/t30?,31-,32-,34+,35+,38+,39+,40+,41+/m1/s1
InChIKey WQLFXXMSVDKBCS-PVYZTMILSA-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 634.940 g/mol
Solvent CDCl3
Source File Reference UWUC6