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2,6-diamino-4-(3-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile

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2,6-diamino-4-(3-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile
SpectraBase Compound ID IzLTqAIYw3I
InChI InChI=1S/C13H9N5O2S/c14-5-9-11(10(6-15)13(17)21-12(9)16)7-2-1-3-8(4-7)18(19)20/h1-4,11H,16-17H2
InChIKey KQIBBFRZHGAINV-UHFFFAOYSA-N
Mol Weight 299.31 g/mol
Molecular Formula C13H9N5O2S
Exact Mass 299.047696 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BXugAd2tHEh
Name 2,6-diamino-4-(3-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H9N5O2S/c14-5-9-11(10(6-15)13(17)21-12(9)16)7-2-1-3-8(4-7)18(19)20/h1-4,11H,16-17H2
InChIKey KQIBBFRZHGAINV-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_815
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: ZI/5125853; Labnumber: TSH-4522; IOH_ID: IOH-000816
Temperature 297 °C