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6-bromo-N-(2-furylmethyl)-2-phenyl-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

6-bromo-N-(2-furylmethyl)-2-phenyl-4-quinolinecarboxamide
SpectraBase Compound ID JytmOCTRtl
InChI InChI=1S/C21H15BrN2O2/c22-15-8-9-19-17(11-15)18(21(25)23-13-16-7-4-10-26-16)12-20(24-19)14-5-2-1-3-6-14/h1-12H,13H2,(H,23,25)
InChIKey QYYRUFJNWVDXAQ-UHFFFAOYSA-N
Mol Weight 407.27 g/mol
Molecular Formula C21H15BrN2O2
Exact Mass 406.031691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5oxPW68pMF2
Name 6-Bromo-N-(2-furylmethyl)-2-phenyl-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
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Exact Mass 406.031690729 u
Formula C21H15BrN2O2
InChI InChI=1S/C21H15BrN2O2/c22-15-8-9-19-17(11-15)18(21(25)23-13-16-7-4-10-26-16)12-20(24-19)14-5-2-1-3-6-14/h1-12H,13H2,(H,23,25)
InChIKey QYYRUFJNWVDXAQ-UHFFFAOYSA-N
Molecular Weight 407.267 g/mol
SMILES N(C(C1=C2C(C=CC(=C2)Br)=NC(=C1)C1=CC=CC=C1)=O)CC=1OC=CC1