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5-Octyl-1H-[1,2,4]triazol-3-ylamine
SpectraBase Compound ID Ggdr6GzxusO
InChI InChI=1S/C10H20N4/c1-2-3-4-5-6-7-8-9-12-10(11)14-13-9/h2-8H2,1H3,(H3,11,12,13,14)
InChIKey XMSYXPMDBIASLP-UHFFFAOYSA-N
Mol Weight 196.3 g/mol
Molecular Formula C10H20N4
Exact Mass 196.168797 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4YsENpVWV9E
Name 5-Octyl-1H-[1,2,4]triazol-3-ylamine
Comments Computed using HOSE algorithm
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Exact Mass 196.168796660 u
Formula C10H20N4
InChI InChI=1S/C10H20N4/c1-2-3-4-5-6-7-8-9-12-10(11)14-13-9/h2-8H2,1H3,(H3,11,12,13,14)
InChIKey XMSYXPMDBIASLP-UHFFFAOYSA-N
Molecular Weight 196.298 g/mol
SMILES C=1(N=C(NN1)CCCCCCCC)N