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8-METHYL-5-(METHYLTHIO)-s-TRIAZOLO[4,3-d]-as-TRIAZINE

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8-METHYL-5-(METHYLTHIO)-s-TRIAZOLO[4,3-d]-as-TRIAZINE
SpectraBase Compound ID JLBTVoIsNl1
InChI InChI=1S/C6H7N5S/c1-4-5-9-7-3-11(5)6(12-2)10-8-4/h3H,1-2H3
InChIKey KOONFKVHRSWWTM-UHFFFAOYSA-N
Mol Weight 181.22 g/mol
Molecular Formula C6H7N5S
Exact Mass 181.042216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xI4md0ce1g
Name 8-METHYL-5-(METHYLTHIO)-s-TRIAZOLO[4,3-d]-as-TRIAZINE
Source of Sample J. Daunis, M. Follet, C. Marzin Org. Magn. Resonance 13, 330(1980)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H7N5S
InChI InChI=1S/C6H7N5S/c1-4-5-9-7-3-11(5)6(12-2)10-8-4/h3H,1-2H3
InChIKey KOONFKVHRSWWTM-UHFFFAOYSA-N
Molecular Weight 181.22
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Jeol PS-100
Synonyms S-TRIAZOLO/4,3-D/-AS-TRIAZINE, 8-METHYL-5-/METHYLTHIO/-,