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N-phenyl-4-(2-pyridinyl)-1-piperazinecarboxamide
SpectraBase Compound ID J1nPO7sPmrz
InChI InChI=1S/C16H18N4O/c21-16(18-14-6-2-1-3-7-14)20-12-10-19(11-13-20)15-8-4-5-9-17-15/h1-9H,10-13H2,(H,18,21)
InChIKey CCEBZZZONAXMFM-UHFFFAOYSA-N
Mol Weight 282.35 g/mol
Molecular Formula C16H18N4O
Exact Mass 282.148061 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EF8eoBmJ6qO
Name N-Phenyl-4-(2-pyridinyl)-1-piperazinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 282.148061215 u
Formula C16H18N4O
InChI InChI=1S/C16H18N4O/c21-16(18-14-6-2-1-3-7-14)20-12-10-19(11-13-20)15-8-4-5-9-17-15/h1-9H,10-13H2,(H,18,21)
InChIKey CCEBZZZONAXMFM-UHFFFAOYSA-N
SMILES C(N1CCN(CC1)C1=NC=CC=C1)(NC=1C=CC=CC1)=O