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4H-thiopyran-3,5-dicarbonitrile, 2,6-diamino-4-[4-(methylthio)phenyl]-
SpectraBase Compound ID DxzfPJ4WXG9
InChI InChI=1S/C14H12N4S2/c1-19-9-4-2-8(3-5-9)12-10(6-15)13(17)20-14(18)11(12)7-16/h2-5,12H,17-18H2,1H3
InChIKey RDUYEMOXBWQWJR-UHFFFAOYSA-N
Mol Weight 300.4 g/mol
Molecular Formula C14H12N4S2
Exact Mass 300.050339 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KpXiAWU2a1G
Name 4H-thiopyran-3,5-dicarbonitrile, 2,6-diamino-4-[4-(methylthio)phenyl]-
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/C14H12N4S2/c1-19-9-4-2-8(3-5-9)12-10(6-15)13(17)20-14(18)11(12)7-16/h2-5,12H,17-18H2,1H3
InChIKey RDUYEMOXBWQWJR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_1045
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: 63LAR2.565; IOH_ID: IOH-008047