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1-methyl-3-methylsulfanyl-1,2,4-triazin-1-ium-5-olate
SpectraBase Compound ID 2R2rsq1oagp
InChI InChI=1S/C5H7N3OS/c1-8-3-4(9)6-5(7-8)10-2/h3H,1-2H3
InChIKey HGWBCIXIDPOGBH-UHFFFAOYSA-N
Mol Weight 157.19 g/mol
Molecular Formula C5H7N3OS
Exact Mass 157.030983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMYfP4MV60C
Name 1-methyl-3-methylsulfanyl-1,2,4-triazin-1-ium-5-olate
CAS Registry Number 104586-09-6
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H7N3OS
InChI InChI=1S/C5H7N3OS/c1-8-3-4(9)6-5(7-8)10-2/h3H,1-2H3
InChIKey HGWBCIXIDPOGBH-UHFFFAOYSA-N
Literature Reference Author E.KOLEHMAINEN,D.SAMAN,A.PISKALA,M.MASOJIDKOVA
Literature Reference Citation MAGN.RES.CHEM.,33,690(1995)
Literature Reference DOI 10.1002/mrc.1260330813
Molecular Weight 157.190 g/mol
Solvent DMSO-D6;C=0.5M
Source File Reference UWCS16643