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KIQRKKMOUDONKV-QEZZMINISA-N
SpectraBase Compound ID HHwAzTL8EL6
InChI InChI=1S/C41H66N2O11SSi2/c1-28(13-12-14-38(51-5)37(47)26-35(45)29(2)22-30(3)36(46)27-39(48)55-18-15-42-31(4)44)21-32-23-33(43-40(49)52-16-19-56(6,7)8)25-34(24-32)54-41(50)53-17-20-57(9,10)11/h12-14,22-25,29,35-36,38,45-46H,15-21,26-27H2,1-11H3,(H,42,44)(H,43,49)/b14-12+,28-13+,30-22+/t29-,35+,36+,38+/m0/s1
InChIKey KIQRKKMOUDONKV-QEZZMINISA-N
Mol Weight 851.2 g/mol
Molecular Formula C41H66N2O11SSi2
Exact Mass 850.392585 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ElX7QUWLBBJ
Name KIQRKKMOUDONKV-QEZZMINISA-N
Compound Number XIX
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H66N2O11SSi2
InChI InChI=1S/C41H66N2O11SSi2/c1-28(13-12-14-38(51-5)37(47)26-35(45)29(2)22-30(3)36(46)27-39(48)55-18-15-42-31(4)44)21-32-23-33(43-40(49)52-16-19-56(6,7)8)25-34(24-32)54-41(50)53-17-20-57(9,10)11/h12-14,22-25,29,35-36,38,45-46H,15-21,26-27H2,1-11H3,(H,42,44)(H,43,49)/b14-12+,28-13+,30-22+/t29-,35+,36+,38+/m0/s1
InChIKey KIQRKKMOUDONKV-QEZZMINISA-N
Literature Reference Author T.FRENZEL,M.BRUNJES,M.QUITSCHALLE,A.KIRSCHNING
Literature Reference Citation ORG.LETTERS,8,135(2006)
Literature Reference DOI 10.1021/ol052588q
Molecular Weight 851.213 g/mol
Sample ID 53326
Solvent CDCl3