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2-Ethyl 3,4-dimethyl (2S*,3S*,4S*,6R*)-5-benzoyl-2-benzylpyrrolidine-2,3,4-tricarboxylate
SpectraBase Compound ID BuSxvPpt2kt
InChI InChI=1S/C25H27NO7/c1-4-33-24(30)25(15-16-11-7-5-8-12-16)19(23(29)32-3)18(22(28)31-2)20(26-25)21(27)17-13-9-6-10-14-17/h5-14,18-20,26H,4,15H2,1-3H3/t18-,19+,20+,25-/m0/s1
InChIKey FAEYVRNJMHHFRW-OZAHESQGSA-N
Mol Weight 453.49 g/mol
Molecular Formula C25H27NO7
Exact Mass 453.178752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VnrsNWR4i
Name 2-Ethyl 3,4-dimethyl (2S*,3S*,4S*,6R*)-5-benzoyl-2-benzylpyrrolidine-2,3,4-tricarboxylate
Alternate Name(s) 2-Ethyl 3,4-dimethyl (2S,3S,4S,5R)-5-benzoyl-2-benzylpyrrolidine-2,3,4-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO7
InChI InChI=1S/C25H27NO7/c1-4-33-24(30)25(15-16-11-7-5-8-12-16)19(23(29)32-3)18(22(28)31-2)20(26-25)21(27)17-13-9-6-10-14-17/h5-14,18-20,26H,4,15H2,1-3H3/t18-,19+,20+,25-/m0/s1
InChIKey FAEYVRNJMHHFRW-OZAHESQGSA-N
Literature Reference DOI 10.1016/j.tet.2015.09.039
Molecular Weight 453.491 g/mol
SMILES N1[C@]([C@]([C@@]([C@@]1(Cc1ccccc1)C(OCC)=O)(C(=O)OC)[H])(C(OC)=O)[H])(C(c1ccccc1)=O)[H]
SPLASH splash10-0a4l-9613000000-3b21866bbc8c09b8a03c
Source of Spectrum F-71-8815-endo_cis_11d
Wiley ID 1803216