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

*Links on SpectraBase are not permalinks.
Acetic acid (S)-1-benzyl-5-oxo-3-(toluene-4-sulfonylamino)-pyrrolidin-2-yl ester
SpectraBase Compound ID Jy8vTTdT70V
InChI InChI=1S/C20H22N2O5S/c1-14-8-10-17(11-9-14)28(25,26)21-18-12-19(24)22(20(18)27-15(2)23)13-16-6-4-3-5-7-16/h3-11,18,20-21H,12-13H2,1-2H3/t18-,20?/m0/s1
InChIKey MZBDRKZZPVLMCV-LROBGIAVSA-N
Mol Weight 402.47 g/mol
Molecular Formula C20H22N2O5S
Exact Mass 402.124943 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 B18tX45PsI4
Name Acetic acid (S)-1-benzyl-5-oxo-3-(toluene-4-sulfonylamino)-pyrrolidin-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O5S
InChI InChI=1S/C20H22N2O5S/c1-14-8-10-17(11-9-14)28(25,26)21-18-12-19(24)22(20(18)27-15(2)23)13-16-6-4-3-5-7-16/h3-11,18,20-21H,12-13H2,1-2H3/t18-,20?/m0/s1
InChIKey MZBDRKZZPVLMCV-LROBGIAVSA-N
Molecular Weight 402.465 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@]1(C(N(C(C1)=O)Cc1ccccc1)OC(=O)C)[H]
SPLASH splash10-0005-5920000000-413f36548439c8dbca77
Source of Spectrum SK-30-2440-9
Synonyms (3S)-1-benzyl-3-{[(4-methylphenyl)sulfonyl]amino}-5-oxopyrrolidinyl acetate (cis + trans)-1-Benzyl-5-acetoxy-4-[(p-toluenesulfonyl)amino]-2-pyrrolidinone
Wiley ID 881527