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

*Links on SpectraBase are not permalinks.
Threo-N-(2-((2,5-dioxopyrrolidin-1-yl)methyl)-3-oxo-1-phenylbutyl)-4-methylbenzenesulfonamide
SpectraBase Compound ID 9d9HCjVNUoZ
InChI InChI=1S/C22H24N2O5S/c1-15-8-10-18(11-9-15)30(28,29)23-22(17-6-4-3-5-7-17)19(16(2)25)14-24-20(26)12-13-21(24)27/h3-11,19,22-23H,12-14H2,1-2H3/t19-,22+/m1/s1
InChIKey IIRIQBVLBZEZNJ-KNQAVFIVSA-N
Mol Weight 428.5 g/mol
Molecular Formula C22H24N2O5S
Exact Mass 428.140593 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 GTck9VyUrJf
Name Threo-N-(2-((2,5-dioxopyrrolidin-1-yl)methyl)-3-oxo-1-phenylbutyl)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O5S
InChI InChI=1S/C22H24N2O5S/c1-15-8-10-18(11-9-15)30(28,29)23-22(17-6-4-3-5-7-17)19(16(2)25)14-24-20(26)12-13-21(24)27/h3-11,19,22-23H,12-14H2,1-2H3/t19-,22+/m1/s1
InChIKey IIRIQBVLBZEZNJ-KNQAVFIVSA-N
Literature Reference DOI 10.1021/jo102143r
Molecular Weight 428.503 g/mol
SMILES N([C@@](c1ccccc1)([C@](CN1C(CCC1=O)=O)(C(=O)C)[H])[H])S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-074i-0790000000-8c9599eb0c1829b9485b
Source of Spectrum J-76-2888/SMS33-threo_6b
Synonyms N-((1R,2S)-2-((2,5-dioxopyrrolidin-1-yl)methyl)-3-oxo-1-phenylbutyl)-4-methylbenzenesulfonamide
Wiley ID 1755566