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2-[5-(Pyridin-3-yl)-1H-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)acetamide
SpectraBase Compound ID B9WJoLk6O4z
InChI InChI=1S/C15H14N6O/c22-14(18-9-11-3-6-16-7-4-11)8-13-19-15(21-20-13)12-2-1-5-17-10-12/h1-7,10H,8-9H2,(H,18,22)(H,19,20,21)
InChIKey UZRUKROKBAENJD-UHFFFAOYSA-N
Mol Weight 294.32 g/mol
Molecular Formula C15H14N6O
Exact Mass 294.122909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JjnW04pSgjn
Name 2-[5-(Pyridin-3-yl)-1H-1,2,4-triazol-3-yl]-N-(pyridin-4-ylmethyl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 294.122909094 u
Formula C15H14N6O
InChI InChI=1S/C15H14N6O/c22-14(18-9-11-3-6-16-7-4-11)8-13-19-15(21-20-13)12-2-1-5-17-10-12/h1-7,10H,8-9H2,(H,18,22)(H,19,20,21)
InChIKey UZRUKROKBAENJD-UHFFFAOYSA-N
Molecular Weight 294.318 g/mol
SMILES C1=CC(C2=NC(CC(NCC=3C=CN=CC3)=O)=NN2)=CN=C1