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(+/-)-(4-R/S,6-Z)-5-HYDROXY-8-(2-METHYLPROPANE-1-SULFONYL)-4,6-DIMETHYLNON-6-EN-3-ONE;MIXTURE-OF-SYN-AND-ANTI
SpectraBase Compound ID 1B4xsj2eTqm
InChI InChI=1S/2C15H28O4S/c2*1-7-14(16)13(6)15(17)11(4)8-12(5)20(18,19)9-10(2)3/h2*8,10,12-13,15,17H,7,9H2,1-6H3/b2*11-8-/t12-,13+,15-;12-,13-,15-/m10/s1
InChIKey FTUGKQWIFFJDOY-KMBPKNRKSA-N
Mol Weight 608.89 g/mol
Molecular Formula C30H56O8S2
Exact Mass 608.341661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1N8Eq2kone
Name (+/-)-(4-R/S,6-Z)-5-HYDROXY-8-(2-METHYLPROPANE-1-SULFONYL)-4,6-DIMETHYLNON-6-EN-3-ONE;MIXTURE-OF-SYN-AND-ANTI
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H56O8S2
InChI InChI=1S/2C15H28O4S/c2*1-7-14(16)13(6)15(17)11(4)8-12(5)20(18,19)9-10(2)3/h2*8,10,12-13,15,17H,7,9H2,1-6H3/b2*11-8-/t12-,13+,15-;12-,13-,15-/m10/s1
InChIKey FTUGKQWIFFJDOY-KMBPKNRKSA-N
Literature Reference Author L.C.BOUCHEZ,C.CRAITA,P.VOGEL
Literature Reference Citation ORG.LETTERS,7,897(2005)
Literature Reference DOI 10.1021/ol050006z
Molecular Weight 608.890 g/mol
Sample ID 42461
Solvent CDCl3