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3-{[2,5-dioxo-1-(2-phenylethyl)-3-pyrrolidinyl]sulfanyl}-1-ethoxy-1-oxo-2-propanaminium chloride
SpectraBase Compound ID ASyBK5dA6m0
InChI InChI=1S/C17H22N2O4S.ClH/c1-2-23-17(22)13(18)11-24-14-10-15(20)19(16(14)21)9-8-12-6-4-3-5-7-12;/h3-7,13-14H,2,8-11,18H2,1H3;1H
InChIKey YOYUTJROXZMONS-UHFFFAOYSA-N
Mol Weight 386.89 g/mol
Molecular Formula C17H23ClN2O4S
Exact Mass 386.106706 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Bjc787f15yF
Name 3-{[2,5-dioxo-1-(2-phenylethyl)-3-pyrrolidinyl]sulfanyl}-1-ethoxy-1-oxo-2-propanaminium chloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H22N2O4S.ClH/c1-2-23-17(22)13(18)11-24-14-10-15(20)19(16(14)21)9-8-12-6-4-3-5-7-12;/h3-7,13-14H,2,8-11,18H2,1H3;1H
InChIKey YOYUTJROXZMONS-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_ASIOH_7529_2081
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/9312118; Labnumber: PE-0119929