For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(3S,4R,5R)-5-Benzyloxy-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-3,4-[N-(p-toluensullfonyl)aziridino]piperidin-2-one

View entire compound with spectra: 1 MS (GC)

(3S,4R,5R)-5-Benzyloxy-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-3,4-[N-(p-toluensullfonyl)aziridino]piperidin-2-one
SpectraBase Compound ID LYQfMHXmkzn
InChI InChI=1S/C29H38N2O6S/c1-19(2)16-23(28(33)37-29(4,5)6)30-17-24(36-18-21-10-8-7-9-11-21)25-26(27(30)32)31(25)38(34,35)22-14-12-20(3)13-15-22/h7-15,19,23-26H,16-18H2,1-6H3/t23-,24+,25-,26-,31?/m0/s1
InChIKey HXCVBTOHHUFWMP-FGGAUHFVSA-N
Mol Weight 542.7 g/mol
Molecular Formula C29H38N2O6S
Exact Mass 542.245058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4vmCnyfMIY6
Name (3S,4R,5R)-5-Benzyloxy-N-[(1S)-1-(tert-butoxycarbonyl)-3-methylbutyl]-3,4-[N-(p-toluensullfonyl)aziridino]piperidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H38N2O6S
InChI InChI=1S/C29H38N2O6S/c1-19(2)16-23(28(33)37-29(4,5)6)30-17-24(36-18-21-10-8-7-9-11-21)25-26(27(30)32)31(25)38(34,35)22-14-12-20(3)13-15-22/h7-15,19,23-26H,16-18H2,1-6H3/t23-,24+,25-,26-,31?/m0/s1
InChIKey HXCVBTOHHUFWMP-FGGAUHFVSA-N
Molecular Weight 542.691 g/mol
SMILES [C@@]12(N([C@]1([C@@](CN(C2=O)[C@](C(OC(C)(C)C)=O)(CC(C)C)[H])(OCc1ccccc1)[H])[H])S(c1ccc(cc1)C)(=O)=O)[H]
SPLASH splash10-0006-9000100000-6c44823345d650e51285
Source of Spectrum KD-13-1000-1
Wiley ID 1635218