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5-Amino-3-methylthio-1-(2,6-xylyl)-1,2,4-triazole

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5-Amino-3-methylthio-1-(2,6-xylyl)-1,2,4-triazole
SpectraBase Compound ID 4BiiGTW65PJ
InChI InChI=1S/C11H14N4S/c1-7-5-4-6-8(2)9(7)15-10(12)13-11(14-15)16-3/h4-6H,1-3H3,(H2,12,13,14)
InChIKey GBNUCNBONTVMKX-UHFFFAOYSA-N
Mol Weight 234.32 g/mol
Molecular Formula C11H14N4S
Exact Mass 234.093918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 17iYy1Ljv3T
Name 5-Amino-3-methylthio-1-(2,6-xylyl)-1,2,4-triazole
CAS Registry Number 84827-94-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H14N4S
InChI InChI=1S/C11H14N4S/c1-7-5-4-6-8(2)9(7)15-10(12)13-11(14-15)16-3/h4-6H,1-3H3,(H2,12,13,14)
InChIKey GBNUCNBONTVMKX-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference P. Dvortsak, J. Reiter, T. Somorai, P.Sohar, Magn. Res. Chem. 23, 194 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3