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4-quinolinecarboxamide, 2-(4-methylphenyl)-N-(3-phenylpropyl)-
SpectraBase Compound ID LibgNyD1TmD
InChI InChI=1S/C26H24N2O/c1-19-13-15-21(16-14-19)25-18-23(22-11-5-6-12-24(22)28-25)26(29)27-17-7-10-20-8-3-2-4-9-20/h2-6,8-9,11-16,18H,7,10,17H2,1H3,(H,27,29)
InChIKey MFFNCFVVKIFOQS-UHFFFAOYSA-N
Mol Weight 380.49 g/mol
Molecular Formula C26H24N2O
Exact Mass 380.188863 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BRUm5wyyPc3
Name 4-Quinolinecarboxamide, 2-(4-methylphenyl)-N-(3-phenylpropyl)-
Comments Computed using HOSE algorithm
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Exact Mass 380.188863400 u
Formula C26H24N2O
InChI InChI=1S/C26H24N2O/c1-19-13-15-21(16-14-19)25-18-23(22-11-5-6-12-24(22)28-25)26(29)27-17-7-10-20-8-3-2-4-9-20/h2-6,8-9,11-16,18H,7,10,17H2,1H3,(H,27,29)
InChIKey MFFNCFVVKIFOQS-UHFFFAOYSA-N
Molecular Weight 380.491 g/mol
SMILES N(C(C=1C=C(C2=CC=C(C=C2)C)N=C2C1C=CC=C2)=O)CCCC1=CC=CC=C1