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[2S-[2R*[(R*),.alpha.(R*),.beta.(S*)]]]-1-[1,1-Dimethylethoxycarbonyl]-.beta.-hydroxy-.alpha.-methyl-2-pyrrolidinepropanoic Acid 2-Hydroxy-1,2,2-triphenylethyl Ester
SpectraBase Compound ID ElZBp4eqftE
InChI InChI=1S/C33H39NO6/c1-23(28(35)27-21-14-22-34(27)31(37)40-32(2,3)4)30(36)39-29(24-15-8-5-9-16-24)33(38,25-17-10-6-11-18-25)26-19-12-7-13-20-26/h5-13,15-20,23,27-29,35,38H,14,21-22H2,1-4H3/t23-,27+,28+,29?/m1/s1
InChIKey XCIVGNFIVHNDKB-XBEVSFSSSA-N
Mol Weight 545.7 g/mol
Molecular Formula C33H39NO6
Exact Mass 545.277738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BRGyhmUkqCE
Name [2S-[2R*[(R*),.alpha.(R*),.beta.(S*)]]]-1-[1,1-Dimethylethoxycarbonyl]-.beta.-hydroxy-.alpha.-methyl-2-pyrrolidinepropanoic Acid 2-Hydroxy-1,2,2-triphenylethyl Ester
Alternate Name(s) isobutyl (2S)-2-[(1S,2R)-1-hydroxy-3-(2-hydroxy-1,2,2-triphenylethoxy)-2-methyl-3-oxopropyl]-1-pyrrolidinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H39NO6
InChI InChI=1S/C33H39NO6/c1-23(28(35)27-21-14-22-34(27)31(37)40-32(2,3)4)30(36)39-29(24-15-8-5-9-16-24)33(38,25-17-10-6-11-18-25)26-19-12-7-13-20-26/h5-13,15-20,23,27-29,35,38H,14,21-22H2,1-4H3/t23-,27+,28+,29?/m1/s1
InChIKey XCIVGNFIVHNDKB-XBEVSFSSSA-N
Molecular Weight 545.676 g/mol
SMILES OC(C(OC([C@@]([C@@]([C@]1(N(C(OC(C)(C)C)=O)CCC1)[H])(O)[H])(C)[H])=O)c1ccccc1)(c1ccccc1)c1ccccc1
SPLASH splash10-08fr-0049000000-4fceec4d303dad6e0f70
Source of Spectrum J-59-6292-7
Wiley ID 1405167