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2-(2-Methyl-5-nitrophenylamino)-4-(3-pyridyl)pyrimidine

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

2-(2-Methyl-5-nitrophenylamino)-4-(3-pyridyl)pyrimidine
SpectraBase Compound ID CCIr8d1oa8r
InChI InChI=1S/C16H13N5O2/c1-11-4-5-13(21(22)23)9-15(11)20-16-18-8-6-14(19-16)12-3-2-7-17-10-12/h2-10H,1H3,(H,18,19,20)
InChIKey OJITWRFPRCHSMX-UHFFFAOYSA-N
Mol Weight 307.31 g/mol
Molecular Formula C16H13N5O2
Exact Mass 307.106925 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G9oDTuwwaC1
Name 2-(2-Methyl-5-nitrophenylamino)-4-(3-pyridyl)pyrimidine
Comments Computed using HOSE algorithm
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Exact Mass 307.106924677 u
Formula C16H13N5O2
InChI InChI=1S/C16H13N5O2/c1-11-4-5-13(21(22)23)9-15(11)20-16-18-8-6-14(19-16)12-3-2-7-17-10-12/h2-10H,1H3,(H,18,19,20)
InChIKey OJITWRFPRCHSMX-UHFFFAOYSA-N
Molecular Weight 307.313 g/mol
SMILES N(C1=NC=CC(=N1)C=1C=NC=CC1)C=1C(=CC=C(C1)N(=O)=O)C