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MESO-4,4'-METHYLENEBIS-[(1R,1'S,6S,6'R)-6-ACETOXYCYCLOHEPT-3-EN-1-YL]-BIS-(4-METHOXYBENZOATE)
SpectraBase Compound ID 86GWu1LsuAp
InChI InChI=1S/C35H40O10/c1-22(36)42-32-18-24(5-11-30(20-32)44-34(38)26-7-13-28(40-3)14-8-26)17-25-6-12-31(21-33(19-25)43-23(2)37)45-35(39)27-9-15-29(41-4)16-10-27/h5-10,13-16,30-33H,11-12,17-21H2,1-4H3/t30-,31+,32+,33-
InChIKey WQIQNVLRGRWNMY-NJRHJFJMSA-N
Mol Weight 620.7 g/mol
Molecular Formula C35H40O10
Exact Mass 620.262147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5muuP3iYC9z
Name MESO-4,4'-METHYLENEBIS-[(1R,1'S,6S,6'R)-6-ACETOXYCYCLOHEPT-3-EN-1-YL]-BIS-(4-METHOXYBENZOATE)
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H40O10
InChI InChI=1S/C35H40O10/c1-22(36)42-32-18-24(5-11-30(20-32)44-34(38)26-7-13-28(40-3)14-8-26)17-25-6-12-31(21-33(19-25)43-23(2)37)45-35(39)27-9-15-29(41-4)16-10-27/h5-10,13-16,30-33H,11-12,17-21H2,1-4H3/t30-,31+,32+,33-
InChIKey WQIQNVLRGRWNMY-NJRHJFJMSA-N
Literature Reference Author S.GERBER-LEMAIRE,A.T.CARMONA,K.T.MEILERT,P.VOGEL
Literature Reference Citation EUR.J.ORG.CHEM.,891(2006)
Molecular Weight 620.697 g/mol
Sample ID 43622
Solvent CDCl3