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4,6(1H,5H)-pyrimidinedione, 5-[[(3-chlorophenyl)amino]methylene]dihydro-2-thioxo-
SpectraBase Compound ID JaB3NMiskI0
InChI InChI=1S/C11H8ClN3O2S/c12-6-2-1-3-7(4-6)13-5-8-9(16)14-11(18)15-10(8)17/h1-5,13H,(H2,14,15,16,17,18)
InChIKey OFKKNKIHYQUSJN-UHFFFAOYSA-N
Mol Weight 281.72 g/mol
Molecular Formula C11H8ClN3O2S
Exact Mass 281.002575 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID InfbzIApWa9
Name 4,6(1H,5H)-pyrimidinedione, 5-[[(3-chlorophenyl)amino]methylene]dihydro-2-thioxo-
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/C11H8ClN3O2S/c12-6-2-1-3-7(4-6)13-5-8-9(16)14-11(18)15-10(8)17/h1-5,13H,(H2,14,15,16,17,18)
InChIKey OFKKNKIHYQUSJN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_2079
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: AG-205/5081363; Labnumber: MAR002214t; IOH_ID: IOH-009082