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5-Amino-2-cyanomethyl-3-methylthio-1,2,4-triazole
SpectraBase Compound ID 1vRsdYdwRa1
InChI InChI=1S/C5H7N5S/c1-11-5-8-4(7)9-10(5)3-2-6/h3H2,1H3,(H2,7,9)
InChIKey KBXOKVDLLZGWBM-UHFFFAOYSA-N
Mol Weight 169.21 g/mol
Molecular Formula C5H7N5S
Exact Mass 169.042216 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KLkkBM7qq3a
Name 5-AMINO-2-CYANOMETHYL-3-METHYLTHIO-1,2,4-TRIAZOLE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H7N5S
InChI InChI=1S/C5H7N5S/c1-11-5-8-4(7)9-10(5)3-2-6/h3H2,1H3,(H2,7,9)
InChIKey KBXOKVDLLZGWBM-UHFFFAOYSA-N
Literature Reference Author P.DVORTSAK,J.REITER,T.SOMORAI,P.SOHAR
Literature Reference Citation MAGN.RES.CHEM.,23,194(1985)
Literature Reference DOI 10.1002/mrc.1260230313
Molecular Weight 169.204 g/mol
Solvent DMSO
Source File Reference UNIW12200