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(2S,5'S,4R)-N-TERT.-BUTYLOXYCARBONYL-2-(4',5'-DIHYDRO-5'-ISOPROPYL-1',3'-OXAZOL-2'-YL)-4-(METHYLSULFONYL)-OXYLPROLINE
SpectraBase Compound ID CfqW6Bflrrd
InChI InChI=1S/2C22H32N2O6S/c2*1-14(2)18-13-28-20(23-18)19-11-16(12-24(19)21(25)29-22(4,5)6)30-31(26,27)17-9-7-15(3)8-10-17/h2*7-10,14,16,18-19H,11-13H2,1-6H3/t2*16-,18+,19+/m11/s1
InChIKey WZVGIYRIIVXFQS-LAWSXJDXSA-N
Mol Weight 905.1 g/mol
Molecular Formula C44H64N4O12S2
Exact Mass 904.396216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ei51AAZr2CL
Name (2S,5'S,4R)-N-TERT.-BUTYLOXYCARBONYL-2-(4',5'-DIHYDRO-5'-ISOPROPYL-1',3'-OXAZOL-2'-YL)-4-(METHYLSULFONYL)-OXYLPROLINE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H64N4O12S2
InChI InChI=1S/2C22H32N2O6S/c2*1-14(2)18-13-28-20(23-18)19-11-16(12-24(19)21(25)29-22(4,5)6)30-31(26,27)17-9-7-15(3)8-10-17/h2*7-10,14,16,18-19H,11-13H2,1-6H3/t2*16-,18+,19+/m11/s1
InChIKey WZVGIYRIIVXFQS-LAWSXJDXSA-N
Literature Reference Author S.R.GILBERTSON,D.XIE,Z.FU
Literature Reference Citation J.ORG.CHEM.,66,7240(2001)
Literature Reference DOI 10.1021/jo0158231
Molecular Weight 905.132 g/mol
Solvent CDCl3
Source File Reference UWLU28531