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2-Pyrimidyl-[4-[(2-pyrimidylamino)methyl]benzyl]amine
SpectraBase Compound ID 4nfJjeKhsvR
InChI InChI=1S/C16H16N6/c1-7-17-15(18-8-1)21-11-13-3-5-14(6-4-13)12-22-16-19-9-2-10-20-16/h1-10H,11-12H2,(H,17,18,21)(H,19,20,22)
InChIKey PXZXYRKDDXKDTK-UHFFFAOYSA-N
Mol Weight 292.35 g/mol
Molecular Formula C16H16N6
Exact Mass 292.143645 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bhu7JwakQSb
Name 2-Pyrimidyl-[4-[(2-pyrimidylamino)methyl]benzyl]amine
Comments Computed using HOSE algorithm
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Exact Mass 292.143644539 u
Formula C16H16N6
InChI InChI=1S/C16H16N6/c1-7-17-15(18-8-1)21-11-13-3-5-14(6-4-13)12-22-16-19-9-2-10-20-16/h1-10H,11-12H2,(H,17,18,21)(H,19,20,22)
InChIKey PXZXYRKDDXKDTK-UHFFFAOYSA-N
Molecular Weight 292.346 g/mol
SMILES C(NC1=NC=CC=N1)C1=CC=C(C=C1)CNC1=NC=CC=N1