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1-METHYL-2-[4'-(6''-BROMOHEXYL)-PHENYL]-4(1H)-QUINOLONE
SpectraBase Compound ID 58vRm60ixhO
InChI InChI=1S/C22H24BrNO/c1-24-20-10-6-5-9-19(20)22(25)16-21(24)18-13-11-17(12-14-18)8-4-2-3-7-15-23/h5-6,9-14,16H,2-4,7-8,15H2,1H3
InChIKey VMBHFNDUXYLCIY-UHFFFAOYSA-N
Mol Weight 398.34 g/mol
Molecular Formula C22H24BrNO
Exact Mass 397.104127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LE4yhpkPO6o
Name 1-METHYL-2-[4'-(6''-BROMOHEXYL)-PHENYL]-4(1H)-QUINOLONE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24BrNO
InChI InChI=1S/C22H24BrNO/c1-24-20-10-6-5-9-19(20)22(25)16-21(24)18-13-11-17(12-14-18)8-4-2-3-7-15-23/h5-6,9-14,16H,2-4,7-8,15H2,1H3
InChIKey VMBHFNDUXYLCIY-UHFFFAOYSA-N
Literature Reference Author A.WUBE,A.HUEFNER,W.SEEBACHER,M.KAISER,R.BRUN,R.BAUER,F.BUCAR
Literature Reference Citation MOLECULES,19,14204(2014)
Literature Reference DOI 10.3390/molecules190914204
Molecular Weight 398.343 g/mol
Solvent CDCl3
Source File Reference UWIR15357