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1-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)ethyl]-4-p-tolyl-1H-1,2,3-triazole
SpectraBase Compound ID vqDQLR1B3z
InChI InChI=1S/C20H20N6/c1-16-7-9-18(10-8-16)20-15-25(24-22-20)12-11-19-14-26(23-21-19)13-17-5-3-2-4-6-17/h2-10,14-15H,11-13H2,1H3
InChIKey ANQOZCLVPMZMKX-UHFFFAOYSA-N
Mol Weight 344.42 g/mol
Molecular Formula C20H20N6
Exact Mass 344.174945 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FYNGN0CXl1N
Name 1-[2-(1-Benzyl-1H-1,2,3-triazol-4-yl)ethyl]-4-p-tolyl-1H-1,2,3-triazole
Comments Computed using HOSE algorithm
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Exact Mass 344.174944668 u
Formula C20H20N6
InChI InChI=1S/C20H20N6/c1-16-7-9-18(10-8-16)20-15-25(24-22-20)12-11-19-14-26(23-21-19)13-17-5-3-2-4-6-17/h2-10,14-15H,11-13H2,1H3
InChIKey ANQOZCLVPMZMKX-UHFFFAOYSA-N
Molecular Weight 344.422 g/mol
SMILES C(N1N=NC(=C1)C=1C=CC(=CC1)C)CC=1N=NN(C1)CC=1C=CC=CC1