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#-4U;(Z)-ENAMINO-TAUTOMER;(-)-(2S,5S,1R)-5-METHYL-2-(1-METHYL-1-PHENYLETHYL)-CYCLOHEXYL-(Z)-4-CHLORO-4,4-DIFLUORO-3-(4-METHOXYANILINO)-2-METHYL-2-BUTENOATE
SpectraBase Compound ID VYVCbHMVzP
InChI InChI=1S/C28H34ClF2NO3/c1-18-11-16-23(27(3,4)20-9-7-6-8-10-20)24(17-18)35-26(33)19(2)25(28(29,30)31)32-21-12-14-22(34-5)15-13-21/h6-10,12-15,18,23-24,32H,11,16-17H2,1-5H3/b25-19-/t18-,23-,24-/m0/s1
InChIKey WPDYQCJZRVUVHG-XKUDFRRFSA-N
Mol Weight 506.0 g/mol
Molecular Formula C28H34ClF2NO3
Exact Mass 505.219528 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8K5TelUtPDl
Name #-4U;(Z)-ENAMINO-TAUTOMER;(-)-(2S,5S,1R)-5-METHYL-2-(1-METHYL-1-PHENYLETHYL)-CYCLOHEXYL-(Z)-4-CHLORO-4,4-DIFLUORO-3-(4-METHOXYANILINO)-2-METHYL-2-BUTENOATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H34ClF2NO3
InChI InChI=1S/C28H34ClF2NO3/c1-18-11-16-23(27(3,4)20-9-7-6-8-10-20)24(17-18)35-26(33)19(2)25(28(29,30)31)32-21-12-14-22(34-5)15-13-21/h6-10,12-15,18,23-24,32H,11,16-17H2,1-5H3/b25-19-/t18-,23-,24-/m0/s1
InChIKey WPDYQCJZRVUVHG-XKUDFRRFSA-N
Literature Reference Author S.FUSTERO,B.PINA,E.SALAVERT,A.NAVARRO,M.C.R.D.ARELLANO,A.S.F UENTES
Literature Reference Citation J.ORG.CHEM.,67,4667(2002)
Literature Reference DOI 10.1021/jo025621k
Solvent CDCl3
Source File Reference UWVN23364