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1-methyl-2-thioxo-nicotinic acid
SpectraBase Compound ID AhaQJ7QVFSr
InChI InChI=1S/C7H7NO2S/c1-8-4-2-3-5(6(8)11)7(9)10/h2-4H,1H3,(H,9,10)
InChIKey MMZRSAPLZXXNLI-UHFFFAOYSA-N
Mol Weight 169.2 g/mol
Molecular Formula C7H7NO2S
Exact Mass 169.01975 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DA5DYtWOrYE
Name 1-methyl-2-thioxo-nicotinic acid
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7NO2S
InChI InChI=1S/C7H7NO2S/c1-8-4-2-3-5(6(8)11)7(9)10/h2-4H,1H3,(H,9,10)
InChIKey MMZRSAPLZXXNLI-UHFFFAOYSA-N
Literature Reference Author L.STEFANIAK,G.A.WEBB,C.BREVARD,M.BOURDONNEAU,R.LEJEUNE,L.THU NUS,C.L.LAPIERE
Literature Reference Citation MAGN.RES.CHEM.,23,790(1985)
Literature Reference DOI 10.1002/mrc.1260230923
Solvent DMSO
Source File Reference UWRH763