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5-cyano-2-keto-6-(methylthio)-1H-pyridine-3-carboxylic acid

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5-cyano-2-keto-6-(methylthio)-1H-pyridine-3-carboxylic acid
SpectraBase Compound ID g7HEbndxau
InChI InChI=1S/C8H6N2O3S/c1-14-7-4(3-9)2-5(8(12)13)6(11)10-7/h2H,1H3,(H,10,11)(H,12,13)
InChIKey DHWIFHCOMJIINQ-UHFFFAOYSA-N
Mol Weight 210.21 g/mol
Molecular Formula C8H6N2O3S
Exact Mass 210.009913 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8iKpBQAUzqh
Name 3-pyridinecarboxylic acid, 5-cyano-1,2-dihydro-6-(methylthio)-2-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 210.009913232 u
Formula C8H6N2O3S
InChI InChI=1S/C8H6N2O3S/c1-14-7-4(3-9)2-5(8(12)13)6(11)10-7/h2H,1H3,(H,10,11)(H,12,13)
InChIKey DHWIFHCOMJIINQ-UHFFFAOYSA-N
Molecular Weight 210.207 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10349
Solvent DMSO-d6
Source Vendor ID: NMR/10241424; Lab Info: DVD; Lab Number: DVD-0000018