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N-(4-butylphenyl)-2-(4-methylphenyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

N-(4-butylphenyl)-2-(4-methylphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID BMkkbj2O7u8
InChI InChI=1S/C27H26N2O/c1-3-4-7-20-12-16-22(17-13-20)28-27(30)24-18-26(21-14-10-19(2)11-15-21)29-25-9-6-5-8-23(24)25/h5-6,8-18H,3-4,7H2,1-2H3,(H,28,30)
InChIKey QVUSIGASDFAWRH-UHFFFAOYSA-N
Mol Weight 394.52 g/mol
Molecular Formula C27H26N2O
Exact Mass 394.204513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4d6XKLC4FK1
Name N-(4-Butylphenyl)-2-(4-methylphenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 394.204513464 u
Formula C27H26N2O
InChI InChI=1S/C27H26N2O/c1-3-4-7-20-12-16-22(17-13-20)28-27(30)24-18-26(21-14-10-19(2)11-15-21)29-25-9-6-5-8-23(24)25/h5-6,8-18H,3-4,7H2,1-2H3,(H,28,30)
InChIKey QVUSIGASDFAWRH-UHFFFAOYSA-N
Molecular Weight 394.518 g/mol
SMILES N(C(C=1C=C(C2=CC=C(C=C2)C)N=C2C1C=CC=C2)=O)C1=CC=C(C=C1)CCCC