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4-pyridinecarboxamide, N-[3-[(2-aminobenzoyl)amino]propyl]-

View entire compound with spectra: 2 NMR

4-pyridinecarboxamide, N-[3-[(2-aminobenzoyl)amino]propyl]-
SpectraBase Compound ID FqTaLE3VJ39
InChI InChI=1S/C16H18N4O2/c17-14-5-2-1-4-13(14)16(22)20-9-3-8-19-15(21)12-6-10-18-11-7-12/h1-2,4-7,10-11H,3,8-9,17H2,(H,19,21)(H,20,22)
InChIKey BRAASTCOMOKBJV-UHFFFAOYSA-N
Mol Weight 298.35 g/mol
Molecular Formula C16H18N4O2
Exact Mass 298.142976 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IGoa5TxHMVG
Name 4-Pyridinecarboxamide, N-[3-[(2-aminobenzoyl)amino]propyl]-
Comments Computed using HOSE algorithm
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Exact Mass 298.142975834 u
Formula C16H18N4O2
InChI InChI=1S/C16H18N4O2/c17-14-5-2-1-4-13(14)16(22)20-9-3-8-19-15(21)12-6-10-18-11-7-12/h1-2,4-7,10-11H,3,8-9,17H2,(H,19,21)(H,20,22)
InChIKey BRAASTCOMOKBJV-UHFFFAOYSA-N
Molecular Weight 298.346 g/mol
SMILES N(C(C=1C(=CC=CC1)N)=O)CCCNC(=O)C=1C=CN=CC1