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4-[6-Bromo-4-(1-pyrrolidinylcarbonyl)-2-quinolinyl]phenyl ethyl ether

View entire compound with spectra: 2 NMR

4-[6-Bromo-4-(1-pyrrolidinylcarbonyl)-2-quinolinyl]phenyl ethyl ether
SpectraBase Compound ID IZQenaECPXY
InChI InChI=1S/C22H21BrN2O2/c1-2-27-17-8-5-15(6-9-17)21-14-19(22(26)25-11-3-4-12-25)18-13-16(23)7-10-20(18)24-21/h5-10,13-14H,2-4,11-12H2,1H3
InChIKey ODICKYPJIFAVSC-UHFFFAOYSA-N
Mol Weight 425.33 g/mol
Molecular Formula C22H21BrN2O2
Exact Mass 424.078641 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JHDZhp0b0sS
Name 4-[6-Bromo-4-(1-pyrrolidinylcarbonyl)-2-quinolinyl]phenyl ethyl ether
Comments Computed using HOSE algorithm
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Exact Mass 424.078640922 u
Formula C22H21BrN2O2
InChI InChI=1S/C22H21BrN2O2/c1-2-27-17-8-5-15(6-9-17)21-14-19(22(26)25-11-3-4-12-25)18-13-16(23)7-10-20(18)24-21/h5-10,13-14H,2-4,11-12H2,1H3
InChIKey ODICKYPJIFAVSC-UHFFFAOYSA-N
Molecular Weight 425.326 g/mol
SMILES CCOC=1C=CC(C2=NC=3C(C(=C2)C(=O)N2CCCC2)=CC(=CC3)Br)=CC1