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(PS)-(E)-(3R,4S,8R)-N-BENZYL-3-CHLORO-4-METHOXYCARBONYL-8-(PHENOXY)-2,3,4,7,8,9-HEXAHYDRO-1H-AZONIN-2-ONE;AMIDE-CONFORMATION-A

View entire compound with spectra: 3 NMR

(PS)-(E)-(3R,4S,8R)-N-BENZYL-3-CHLORO-4-METHOXYCARBONYL-8-(PHENOXY)-2,3,4,7,8,9-HEXAHYDRO-1H-AZONIN-2-ONE;AMIDE-CONFORMATION-A
SpectraBase Compound ID 5Z2XtA7rFhv
InChI InChI=1S/C23H24ClNO4/c1-28-23(27)20-14-8-13-19(29-18-11-6-3-7-12-18)16-25(22(26)21(20)24)15-17-9-4-2-5-10-17/h2-12,14,19-21H,13,15-16H2,1H3/b14-8+/t19-,20-,21-/m1/s1
InChIKey LLHFMUQFXKBZCN-HSWGUCTJSA-N
Mol Weight 413.9 g/mol
Molecular Formula C23H24ClNO4
Exact Mass 413.139386 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1FUQXPvNEuK
Name (PR)-(E)-(3R,4S,8R)-N-BENZYL-3-CHLORO-4-METHOXYCARBONYL-8-(PHENOXY)-2,3,4,7,8,9-HEXAHYDRO-1H-AZONIN-2-ONE
Compound Number 8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H24ClNO4
InChI InChI=1S/C23H24ClNO4/c1-28-23(27)20-14-8-13-19(29-18-11-6-3-7-12-18)16-25(22(26)21(20)24)15-17-9-4-2-5-10-17/h2-12,14,19-21H,13,15-16H2,1H3/b14-8+/t19-,20-,21-/m1/s1
InChIKey LLHFMUQFXKBZCN-HSWGUCTJSA-N
Literature Reference Author F.BOHLAND,I.ERLIN,L.PLATTE,M.SCHROEDER,D.SCHOLLMEYER,U.NUBBE MEYER
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6272(2014)
Literature Reference DOI 10.1002/ejoc.201402720
Molecular Weight 413.901 g/mol
Solvent CDCl3
Source File Reference UWIR19180