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(3'S,4'bS,8'aS)-3',4'b,8',8'-tetramethylspiro[1,3-dioxolane-2,2'-1,4,5,6,7,8a,9,10-octahydrophenanthrene]-3'-carboxylic acid

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(3'S,4'bS,8'aS)-3',4'b,8',8'-tetramethylspiro[1,3-dioxolane-2,2'-1,4,5,6,7,8a,9,10-octahydrophenanthrene]-3'-carboxylic acid
SpectraBase Compound ID 1PxUlyD3BmT
InChI InChI=1S/C21H32O4/c1-18(2)8-5-9-19(3)15-13-20(4,17(22)23)21(24-10-11-25-21)12-14(15)6-7-16(18)19/h16H,5-13H2,1-4H3,(H,22,23)/t16-,19+,20+/m0/s1
InChIKey XCKCZRHDIXGMNX-PWIZWCRZSA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DkYdAIcEQoj
Name (3'S,4'bS,8'aS)-3',4'b,8',8'-tetramethylspiro[1,3-dioxolane-2,2'-1,4,5,6,7,8a,9,10-octahydrophenanthrene]-3'-carboxylic acid
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-18(2)8-5-9-19(3)15-13-20(4,17(22)23)21(24-10-11-25-21)12-14(15)6-7-16(18)19/h16H,5-13H2,1-4H3,(H,22,23)/t16-,19+,20+/m0/s1
InChIKey XCKCZRHDIXGMNX-PWIZWCRZSA-N
Literature Reference Author M.ARNO,M.A.GONZALEZ,M.L.MARIN,R.J.ZARAGOZA
Literature Reference Citation MAGN.RES.CHEM.,39,414(2001)
Literature Reference DOI 10.1002/mrc.841
Molecular Weight 348.483 g/mol
Solvent CDCl3
Source File Reference UWKP6321