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DIMETHYL-(2S,5S)-1-[N-(2-BENZOYLETHYL)-N-TOSYLGLYCYL]-PYRROLIDINE-2,5-DICARBOXYLATE
SpectraBase Compound ID bgSU4fF6qR
InChI InChI=1S/C26H30N2O8S/c1-18-9-11-20(12-10-18)37(33,34)27(16-15-23(29)19-7-5-4-6-8-19)17-24(30)28-21(25(31)35-2)13-14-22(28)26(32)36-3/h4-12,21-22H,13-17H2,1-3H3/t21-,22-/m0/s1
InChIKey WXKPXBOFZOCTLX-VXKWHMMOSA-N
Mol Weight 530.59 g/mol
Molecular Formula C26H30N2O8S
Exact Mass 530.172287 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LgaIZ91NHKs
Name DIMETHYL-(2S,5S)-1-[N-(2-BENZOYLETHYL)-N-TOSYLGLYCYL]-PYRROLIDINE-2,5-DICARBOXYLATE
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30N2O8S
InChI InChI=1S/C26H30N2O8S/c1-18-9-11-20(12-10-18)37(33,34)27(16-15-23(29)19-7-5-4-6-8-19)17-24(30)28-21(25(31)35-2)13-14-22(28)26(32)36-3/h4-12,21-22H,13-17H2,1-3H3/t21-,22-/m0/s1
InChIKey WXKPXBOFZOCTLX-VXKWHMMOSA-N
Literature Reference Author P.WESSIG,P.WETTSTEIN,B.GIESE,M.NEUBURGER,M.ZEHNDER
Literature Reference Citation HELV.CHIM.ACTA,77,829(1994)
Literature Reference DOI 10.1002/hlca.19940770322
Molecular Weight 530.593 g/mol
Solvent CDCl3
Source File Reference UWSK2206