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CIS-7-(4-PHENYL-2-OXOOXAZOLIDINYL)-8-OXO-3-(PHENYLTHIO)-1-AZABICYCLO-[4.2.0]-OCTANE-2-CARBOXYLIC-ACID-(4-NITROPHENYL)-METHYLESTER
SpectraBase Compound ID 8fUnMBFBV15
InChI InChI=1S/C30H27N3O7S/c34-28-26(32-24(18-40-30(32)36)20-7-3-1-4-8-20)23-15-16-25(41-22-9-5-2-6-10-22)27(31(23)28)29(35)39-17-19-11-13-21(14-12-19)33(37)38/h1-14,23-27H,15-18H2/t23-,24-,25?,26+,27?/m1/s1
InChIKey CEUOGTWGIBFXKJ-QYMKMASMSA-N
Mol Weight 573.62 g/mol
Molecular Formula C30H27N3O7S
Exact Mass 573.156971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6kNeJ4F74td
Name CIS-7-(4-PHENYL-2-OXOOXAZOLIDINYL)-8-OXO-3-(PHENYLTHIO)-1-AZABICYCLO-[4.2.0]-OCTANE-2-CARBOXYLIC-ACID-(4-NITROPHENYL)-METHYLESTER
Compound Number 8D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H27N3O7S
InChI InChI=1S/C30H27N3O7S/c34-28-26(32-24(18-40-30(32)36)20-7-3-1-4-8-20)23-15-16-25(41-22-9-5-2-6-10-22)27(31(23)28)29(35)39-17-19-11-13-21(14-12-19)33(37)38/h1-14,23-27H,15-18H2/t23-,24-,25?,26+,27?/m1/s1
InChIKey CEUOGTWGIBFXKJ-QYMKMASMSA-N
Literature Reference Author R.S.MILLER,D.W.HOARD,R.A.JOHNSON,W.D.LUKE
Literature Reference Citation J.ORG.CHEM.,59,3289(1994)
Literature Reference DOI 10.1021/jo00091a014
Molecular Weight 573.620 g/mol
Solvent CDCl3
Source File Reference UWCP2592