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(+/-)-(4RS,5Z,7SR)-5-METHYL-7-(METHYLSULFONYL)-4-[(RS)-1-(2,4,6-TRIISOPROPYLPHENYL)-ETHOXY]-OCT-5-EN-2-ONE
SpectraBase Compound ID 6y7HFt4DPMG
InChI InChI=1S/C27H44O4S/c1-16(2)23-14-24(17(3)4)27(25(15-23)18(5)6)22(10)31-26(13-20(8)28)19(7)12-21(9)32(11,29)30/h12,14-18,21-22,26H,13H2,1-11H3/b19-12-/t21?,22?,26-/m1/s1
InChIKey VWZZEYDMUXKLMP-UITLFFKDSA-N
Mol Weight 464.7 g/mol
Molecular Formula C27H44O4S
Exact Mass 464.296031 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ObtbVOBEMa
Name (+/-)-(4RS,5Z,7SR)-5-METHYL-7-(METHYLSULFONYL)-4-[(RS)-1-(2,4,6-TRIISOPROPYLPHENYL)-ETHOXY]-OCT-5-EN-2-ONE
Compound Number 92
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44O4S
InChI InChI=1S/C27H44O4S/c1-16(2)23-14-24(17(3)4)27(25(15-23)18(5)6)22(10)31-26(13-20(8)28)19(7)12-21(9)32(11,29)30/h12,14-18,21-22,26H,13H2,1-11H3/b19-12-/t21?,22?,26-/m1/s1
InChIKey VWZZEYDMUXKLMP-UITLFFKDSA-N
Literature Reference Author V.NARKEVITCH,S.MEGEVAND,K.SCHENK,P.VOGEL
Literature Reference Citation J.ORG.CHEM.,66,5080(2001)
Literature Reference DOI 10.1021/jo0101712
Molecular Weight 464.704 g/mol
Solvent CDCl3
Source File Reference UWLU27154