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4,6(1H,5H)-pyrimidinedione, dihydro-1-(4-methylphenyl)-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-2-thioxo-, (5E)-
SpectraBase Compound ID Bwl7peAEFaF
InChI InChI=1S/C17H15N3O2S/c1-11-5-7-12(8-6-11)20-16(22)14(15(21)18-17(20)23)10-13-4-3-9-19(13)2/h3-10H,1-2H3,(H,18,21,23)/b14-10+
InChIKey ZVPPWSKNOPHNQR-GXDHUFHOSA-N
Mol Weight 325.39 g/mol
Molecular Formula C17H15N3O2S
Exact Mass 325.088498 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JtAwN0auUB5
Name 4,6(1H,5H)-pyrimidinedione, dihydro-1-(4-methylphenyl)-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-2-thioxo-, (5E)-
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/C17H15N3O2S/c1-11-5-7-12(8-6-11)20-16(22)14(15(21)18-17(20)23)10-13-4-3-9-19(13)2/h3-10H,1-2H3,(H,18,21,23)/b14-10+
InChIKey ZVPPWSKNOPHNQR-GXDHUFHOSA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_2430
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/9253487; Labnumber: LP-0020129