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4-pyridinecarboxylic acid, 3-cyano-1,2-dihydro-6-methyl-2-thioxo-,ethyl ester
SpectraBase Compound ID JFWHkPMrlYN
InChI InChI=1S/C10H10N2O2S/c1-3-14-10(13)7-4-6(2)12-9(15)8(7)5-11/h4H,3H2,1-2H3,(H,12,15)
InChIKey WBMMFDGNOQLZNF-UHFFFAOYSA-N
Mol Weight 222.26 g/mol
Molecular Formula C10H10N2O2S
Exact Mass 222.046299 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CufEAfdY2Rr
Name 4-pyridinecarboxylic acid, 3-cyano-1,2-dihydro-6-methyl-2-thioxo-,ethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.046298742 u
Formula C10H10N2O2S
InChI InChI=1S/C10H10N2O2S/c1-3-14-10(13)7-4-6(2)12-9(15)8(7)5-11/h4H,3H2,1-2H3,(H,12,15)
InChIKey WBMMFDGNOQLZNF-UHFFFAOYSA-N
Molecular Weight 222.262 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_9452
Solvent DMSO-d6
Source Vendor ID: NMR/9211625; Lab Info: L-25; Lab Number: L-25,Kalugin