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#16;MAJOR;(1'RS,2'RS,4'RS,4A'SR,10A'SR)-1-[7'-METHOXY-1''-METHOXY-SPIRO-(CYCLOPROPANE-1',1')-2'-METHYL-1',2',3',4',4A',9',10',10A'-OCTAHYDROPHENANTHREN-4'-YL]-P
SpectraBase Compound ID 9r9VjlDVWVS
InChI InChI=1S/C29H36O4/c1-5-25(33-28(30)19-9-7-6-8-10-19)23-15-18(2)29(17-26(29)32-4)24-14-11-20-16-21(31-3)12-13-22(20)27(23)24/h6-10,12-13,16,18,23-27H,5,11,14-15,17H2,1-4H3/t18-,23+,24+,25?,26?,27-,29+/m1/s1
InChIKey VOZMNRKLXRECMV-BCKJKMLBSA-N
Mol Weight 448.6 g/mol
Molecular Formula C29H36O4
Exact Mass 448.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8PDUhBAEfe3
Name #16;MAJOR;(1'RS,2'RS,4'RS,4A'SR,10A'SR)-1-[7'-METHOXY-1''-METHOXY-SPIRO-(CYCLOPROPANE-1',1')-2'-METHYL-1',2',3',4',4A',9',10',10A'-OCTAHYDROPHENANTHREN-4'-YL]-P
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H36O4
InChI InChI=1S/C29H36O4/c1-5-25(33-28(30)19-9-7-6-8-10-19)23-15-18(2)29(17-26(29)32-4)24-14-11-20-16-21(31-3)12-13-22(20)27(23)24/h6-10,12-13,16,18,23-27H,5,11,14-15,17H2,1-4H3/t18-,23+,24+,25?,26?,27-,29+/m1/s1
InChIKey VOZMNRKLXRECMV-BCKJKMLBSA-N
Literature Reference Author K.A.FAIRWEATHER,L.N.MANDER
Literature Reference Citation ORG.LETTERS,8,3395(2006)
Literature Reference DOI 10.1021/ol061228f
Molecular Weight 448.602 g/mol
Sample ID 60513
Solvent CDCl3