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(4'RS,4A'SR,10A'RS)-1-(10A'-HYDROXYMETHYL-7'-METHOXY-2'-METHYL-3',4',4A',9',10',10A'-HEXAHYDROPHENANTHREN-4'-YL)-PROPAN-1-ONE

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(4'RS,4A'SR,10A'RS)-1-(10A'-HYDROXYMETHYL-7'-METHOXY-2'-METHYL-3',4',4A',9',10',10A'-HEXAHYDROPHENANTHREN-4'-YL)-PROPAN-1-ONE
SpectraBase Compound ID Cc4bYGHQTqL
InChI InChI=1S/C20H26O3/c1-4-18(22)17-9-13(2)11-20(12-21)8-7-14-10-15(23-3)5-6-16(14)19(17)20/h5-6,10-11,17,19,21H,4,7-9,12H2,1-3H3/t17-,19+,20-/m0/s1
InChIKey WRJOVXBSKUZVPL-SXLOBPIMSA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bn0MY2peYDw
Name (4'RS,4A'SR,10A'RS)-1-(10A'-HYDROXYMETHYL-7'-METHOXY-2'-METHYL-3',4',4A',9',10',10A'-HEXAHYDROPHENANTHREN-4'-YL)-PROPAN-1-ONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-4-18(22)17-9-13(2)11-20(12-21)8-7-14-10-15(23-3)5-6-16(14)19(17)20/h5-6,10-11,17,19,21H,4,7-9,12H2,1-3H3/t17-,19+,20-/m0/s1
InChIKey WRJOVXBSKUZVPL-SXLOBPIMSA-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 314.425 g/mol
Sample ID 60504
Solvent CDCl3