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METHYL-(1R)-1-[2-(1-METHYL-2-[[(TRIFLUOROMETHYL)-SULFONYL]-OXY]-CYCLOPENT-2-EN-1-YL)-ETHYL]-CYCLOHEXA-2,5-DIENE-1-CARBOXYLATE

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METHYL-(1R)-1-[2-(1-METHYL-2-[[(TRIFLUOROMETHYL)-SULFONYL]-OXY]-CYCLOPENT-2-EN-1-YL)-ETHYL]-CYCLOHEXA-2,5-DIENE-1-CARBOXYLATE
SpectraBase Compound ID 1Uxbl4NnJJi
InChI InChI=1S/C17H21F3O5S/c1-15(8-6-7-13(15)25-26(22,23)17(18,19)20)11-12-16(14(21)24-2)9-4-3-5-10-16/h4-5,7,9-10H,3,6,8,11-12H2,1-2H3/t15-/m1/s1
InChIKey ISOVJWUPPVDJAQ-OAHLLOKOSA-N
Mol Weight 394.41 g/mol
Molecular Formula C17H21F3O5S
Exact Mass 394.106179 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JtLr1e317KB
Name METHYL-(1R)-1-[2-(1-METHYL-2-[[(TRIFLUOROMETHYL)-SULFONYL]-OXY]-CYCLOPENT-2-EN-1-YL)-ETHYL]-CYCLOHEXA-2,5-DIENE-1-CARBOXYLATE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21F3O5S
InChI InChI=1S/C17H21F3O5S/c1-15(8-6-7-13(15)25-26(22,23)17(18,19)20)11-12-16(14(21)24-2)9-4-3-5-10-16/h4-5,7,9-10H,3,6,8,11-12H2,1-2H3/t15-/m1/s1
InChIKey ISOVJWUPPVDJAQ-OAHLLOKOSA-N
Literature Reference Author E.DREGE,C.TOMINIAUX,G.MAORGANT,D.DESMAELE
Literature Reference Citation EUR.J.ORG.CHEM.,4825(2006)
Molecular Weight 394.406 g/mol
Sample ID 44286
Solvent CDCl3