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4-quinolinecarboxamide, 2-(2-chlorophenyl)-N-cyclopentyl-
SpectraBase Compound ID AJ7JiSWKBst
InChI InChI=1S/C21H19ClN2O/c22-18-11-5-3-10-16(18)20-13-17(15-9-4-6-12-19(15)24-20)21(25)23-14-7-1-2-8-14/h3-6,9-14H,1-2,7-8H2,(H,23,25)
InChIKey AUVHNWOSJDFDSD-UHFFFAOYSA-N
Mol Weight 350.85 g/mol
Molecular Formula C21H19ClN2O
Exact Mass 350.118591 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID XvtFdmj7Gc
Name 4-Quinolinecarboxamide, 2-(2-chlorophenyl)-N-cyclopentyl-
Comments Computed using HOSE algorithm
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Exact Mass 350.118590939 u
Formula C21H19ClN2O
InChI InChI=1S/C21H19ClN2O/c22-18-11-5-3-10-16(18)20-13-17(15-9-4-6-12-19(15)24-20)21(25)23-14-7-1-2-8-14/h3-6,9-14H,1-2,7-8H2,(H,23,25)
InChIKey AUVHNWOSJDFDSD-UHFFFAOYSA-N
Molecular Weight 350.849 g/mol
SMILES N(C(C=1C=C(N=C2C=CC=CC12)C1=C(Cl)C=CC=C1)=O)C1CCCC1