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(2S)-1-[(2S)-3-(benzyloxy)-2-(pivaloylamino)propanoyl]-N-methyl-pyrrolidine-2-carboxamide
SpectraBase Compound ID 4O4IoDH6Ext
InChI InChI=1S/C21H31N3O4/c1-21(2,3)20(27)23-16(14-28-13-15-9-6-5-7-10-15)19(26)24-12-8-11-17(24)18(25)22-4/h5-7,9-10,16-17H,8,11-14H2,1-4H3,(H,22,25)(H,23,27)/t16-,17-/m0/s1
InChIKey ISXUQJMNXUTNRW-IRXDYDNUSA-N
Mol Weight 389.5 g/mol
Molecular Formula C21H31N3O4
Exact Mass 389.231456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 12skkpA068V
Name (2S)-1-[(2S)-3-(benzyloxy)-2-(pivaloylamino)propanoyl]-N-methyl-pyrrolidine-2-carboxamide
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31N3O4
InChI InChI=1S/C21H31N3O4/c1-21(2,3)20(27)23-16(14-28-13-15-9-6-5-7-10-15)19(26)24-12-8-11-17(24)18(25)22-4/h5-7,9-10,16-17H,8,11-14H2,1-4H3,(H,22,25)(H,23,27)/t16-,17-/m0/s1
InChIKey ISXUQJMNXUTNRW-IRXDYDNUSA-N
Literature Reference Author A.AVENOZA,J.H.BUSTO,J.M.PEREGRINA,F.RODRIGUEZ
Literature Reference Citation J.ORG.CHEM.,67,4241(2002)
Literature Reference DOI 10.1021/jo016406r
Molecular Weight 389.495 g/mol
Solvent CDCl3
Source File Reference UWVN23066