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#49;(1S)-[1-[2-(3-ISOPROPYL-1-METHYL-2-[[(TRIFLUOROMETHYL)-SULFONYL]-OXY]-CYCLOPENT-2-EN-1-YL)-ETHYL]-4-OXOCYCLOHEXA-2,5-DIEN-1-YL]-METHYL-2,2-DIMETHYLPROPANOA

View entire compound with spectra: 2 NMR

#49;(1S)-[1-[2-(3-ISOPROPYL-1-METHYL-2-[[(TRIFLUOROMETHYL)-SULFONYL]-OXY]-CYCLOPENT-2-EN-1-YL)-ETHYL]-4-OXOCYCLOHEXA-2,5-DIEN-1-YL]-METHYL-2,2-DIMETHYLPROPANOA
SpectraBase Compound ID LWsvA6O7tF0
InChI InChI=1S/C24H33F3O6S/c1-16(2)18-9-10-22(6,19(18)33-34(30,31)24(25,26)27)13-14-23(11-7-17(28)8-12-23)15-32-20(29)21(3,4)5/h7-8,11-12,16H,9-10,13-15H2,1-6H3/t22-/m1/s1
InChIKey MJYAIUIIMLOZFD-JOCHJYFZSA-N
Mol Weight 506.6 g/mol
Molecular Formula C24H33F3O6S
Exact Mass 506.194994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDlOgipdWrp
Name #49;(1S)-[1-[2-(3-ISOPROPYL-1-METHYL-2-[[(TRIFLUOROMETHYL)-SULFONYL]-OXY]-CYCLOPENT-2-EN-1-YL)-ETHYL]-4-OXOCYCLOHEXA-2,5-DIEN-1-YL]-METHYL-2,2-DIMETHYLPROPANOA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H33F3O6S
InChI InChI=1S/C24H33F3O6S/c1-16(2)18-9-10-22(6,19(18)33-34(30,31)24(25,26)27)13-14-23(11-7-17(28)8-12-23)15-32-20(29)21(3,4)5/h7-8,11-12,16H,9-10,13-15H2,1-6H3/t22-/m1/s1
InChIKey MJYAIUIIMLOZFD-JOCHJYFZSA-N
Literature Reference Author E.DREGE,C.TOMINIAUX,G.MAORGANT,D.DESMAELE
Literature Reference Citation EUR.J.ORG.CHEM.,4825(2006)
Molecular Weight 506.578 g/mol
Sample ID 44307
Solvent CDCl3