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3-METHYLTHIO-5-(3-ETHYL-3-METHYL-1-TRIAZENO)-PYRAZOLE-4-CARBONITRILE
SpectraBase Compound ID JpjtdL9az3W
InChI InChI=1S/C8H12N6S/c1-4-14(2)13-11-7-6(5-9)8(15-3)12-10-7/h4H2,1-3H3,(H,10,12)/b13-11+
InChIKey VGFKGZTZNMNQAC-ACCUITESSA-N
Mol Weight 224.29 g/mol
Molecular Formula C8H12N6S
Exact Mass 224.084416 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1BPmFJOlJXy
Name 3-METHYLTHIO-5-(3-ETHYL-3-METHYL-1-TRIAZENO)-PYRAZOLE-4-CARBONITRILE
Compound Number 4G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12N6S
InChI InChI=1S/C8H12N6S/c1-4-14(2)13-11-7-6(5-9)8(15-3)12-10-7/h4H2,1-3H3,(H,10,12)/b13-11+
InChIKey VGFKGZTZNMNQAC-ACCUITESSA-N
Literature Reference Author J.S.LARSEN,M.A.ZAHRAN,E.B.PEDERSEN,C.NIELSEN
Literature Reference Citation MH.CHEM.,130,1167(1999)
Literature Reference DOI 10.1007/s007060050276
Molecular Weight 224.283 g/mol
Solvent DMSO-D6
Source File Reference UWCS24589