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(7'Z,1''-ALPHA,4A''-BETA,8A''-ALPHA)-2-[3',7'-DIMETHYL-9'-(2'',5'',5'',8A''-TETRAMETHYL-1'',4'',4A'',5'',6'',7'',8'',8A''-OCTAHYDRONAPHTHALEN-1''-YL)-NON-7'-
SpectraBase Compound ID Ay95t5oClq0
InChI InChI=1S/C31H48O6S.Na/c1-21(11-13-24-19-25(32)14-15-27(24)33)9-7-10-23(3)28(37-38(34,35)36)20-26-22(2)12-16-29-30(4,5)17-8-18-31(26,29)6;/h11-12,14-15,19,23,26,28-29,32-33H,7-10,13,16-18,20H2,1-6H3,(H,34,35,36);/q;+1/p-1/b21-11+;/t23?,26-,28?,29-,31+;/m0./s1
InChIKey MWESFEYZPAHLCJ-NGKUZUCASA-M
Mol Weight 570.8 g/mol
Molecular Formula C31H47NaO6S
Exact Mass 570.299105 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GUpLadJlk5u
Name (7'Z,1''-ALPHA,4A''-BETA,8A''-ALPHA)-2-[3',7'-DIMETHYL-9'-(2'',5'',5'',8A''-TETRAMETHYL-1'',4'',4A'',5'',6'',7'',8'',8A''-OCTAHYDRONAPHTHALEN-1''-YL)-NON-7'-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H47NaO6S
InChI InChI=1S/C31H48O6S.Na/c1-21(11-13-24-19-25(32)14-15-27(24)33)9-7-10-23(3)28(37-38(34,35)36)20-26-22(2)12-16-29-30(4,5)17-8-18-31(26,29)6;/h11-12,14-15,19,23,26,28-29,32-33H,7-10,13,16-18,20H2,1-6H3,(H,34,35,36);/q;+1/p-1/b21-11+;/t23?,26-,28?,29-,31+;/m0./s1
InChIKey MWESFEYZPAHLCJ-NGKUZUCASA-M
Literature Reference Author G.V.ALEA,A.R.CARROLL,B.F.BOWDEN
Literature Reference Citation AUSTR.J.CHEM.,47,191(1994)
Literature Reference DOI 10.1071/ch9940191
Molecular Weight 570.760 g/mol
Solvent CD3OD
Source File Reference UWRK1703