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3-[3-({(Z)-(methylamino)[(Z)-methylimino]methyl}sulfanyl)-2,5-dioxo-1-pyrrolidinyl]benzoic acid
SpectraBase Compound ID CiLYi8uunbj
InChI InChI=1S/C14H15N3O4S/c1-15-14(16-2)22-10-7-11(18)17(12(10)19)9-5-3-4-8(6-9)13(20)21/h3-6,10H,7H2,1-2H3,(H,15,16)(H,20,21)
InChIKey UQHILZYUERPLEP-UHFFFAOYSA-N
Mol Weight 321.35 g/mol
Molecular Formula C14H15N3O4S
Exact Mass 321.078327 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JFQs6FiWoUD
Name 3-[3-({(Z)-(methylamino)[(Z)-methylimino]methyl}sulfanyl)-2,5-dioxo-1-pyrrolidinyl]benzoic acid
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/C14H15N3O4S/c1-15-14(16-2)22-10-7-11(18)17(12(10)19)9-5-3-4-8(6-9)13(20)21/h3-6,10H,7H2,1-2H3,(H,15,16)(H,20,21)
InChIKey UQHILZYUERPLEP-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_ASIOH_7529_2241
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/9321104; Labnumber: PE-0129903