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4-Pyridinemethanamine, N-[4-(4-methoxyphenoxy)-1,2,5-oxadiazol-3-yl]-
SpectraBase Compound ID DckBa9JPbsh
InChI InChI=1S/C15H14N4O3/c1-20-12-2-4-13(5-3-12)21-15-14(18-22-19-15)17-10-11-6-8-16-9-7-11/h2-9H,10H2,1H3,(H,17,18)
InChIKey OVQBHIAQNANCRF-UHFFFAOYSA-N
Mol Weight 298.3 g/mol
Molecular Formula C15H14N4O3
Exact Mass 298.10659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AyZW053lskd
Name 4-Pyridinemethanamine, N-[4-(4-methoxyphenoxy)-1,2,5-oxadiazol-3-yl]-
Comments Computed using HOSE algorithm
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Exact Mass 298.106590324 u
Formula C15H14N4O3
InChI InChI=1S/C15H14N4O3/c1-20-12-2-4-13(5-3-12)21-15-14(18-22-19-15)17-10-11-6-8-16-9-7-11/h2-9H,10H2,1H3,(H,17,18)
InChIKey OVQBHIAQNANCRF-UHFFFAOYSA-N
SMILES C=1(C(=NON1)NCC1=CC=NC=C1)OC1=CC=C(OC)C=C1