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(2R,4S)-1-[(R)-1-Benzylamino-2-phenethyl]-2-tert-butoxycarbonyl-4-methoxycarbonyl-4-methylpyrrolidine
SpectraBase Compound ID 1QURtC97Hto
InChI InChI=1S/C27H36N2O4/c1-26(2,3)33-24(30)22-17-27(4,25(31)32-5)19-29(22)23(16-20-12-8-6-9-13-20)28-18-21-14-10-7-11-15-21/h6-15,22-23,28H,16-19H2,1-5H3/t22-,23-,27+/m1/s1
InChIKey VIRUMDBAAHFHRR-NOTUOJBMSA-N
Mol Weight 452.6 g/mol
Molecular Formula C27H36N2O4
Exact Mass 452.267508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AF0HkpA2DeW
Name (2R,4S)-1-[(R)-1-Benzylamino-2-phenethyl]-2-tert-butoxycarbonyl-4-methoxycarbonyl-4-methylpyrrolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36N2O4
InChI InChI=1S/C27H36N2O4/c1-26(2,3)33-24(30)22-17-27(4,25(31)32-5)19-29(22)23(16-20-12-8-6-9-13-20)28-18-21-14-10-7-11-15-21/h6-15,22-23,28H,16-19H2,1-5H3/t22-,23-,27+/m1/s1
InChIKey VIRUMDBAAHFHRR-NOTUOJBMSA-N
Molecular Weight 452.595 g/mol
SMILES N([C@](N1[C@@](C(OC(C)(C)C)=O)(C[C@@](C1)(C(=O)OC)C)[H])(Cc1ccccc1)[H])Cc1ccccc1
SPLASH splash10-004l-6093000000-159db72f65992cc766db
Source of Spectrum F-67-8929-4e
Wiley ID 1691150