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5-Methyl-4-(propan-2-ylideneamino)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 7jPrJI9QI4s
InChI InChI=1S/C6H10N4S/c1-4(2)9-10-5(3)7-8-6(10)11/h1-3H3,(H,8,11)
InChIKey CISUMCJIHPVDKN-UHFFFAOYSA-N
Mol Weight 170.23 g/mol
Molecular Formula C6H10N4S
Exact Mass 170.062618 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HOGi7wb8wb4
Name 4H-1,2,4-Triazole-3-thiol, 5-methyl-4-[(1-methylethylidene)amino]-
Comments Computed using HOSE algorithm
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Exact Mass 170.062617512 u
Formula C6H10N4S
InChI InChI=1S/C6H10N4S/c1-4(2)9-10-5(3)7-8-6(10)11/h1-3H3,(H,8,11)
InChIKey CISUMCJIHPVDKN-UHFFFAOYSA-N
Molecular Weight 170.234 g/mol
SMILES CC(C)=NN1C(C)=NN=C1S