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1-(2-BROMOETHYL)-2-[(1'E)-(4''-PENTOXYPHENYL)-ETHENYL]-4(1H)-QUINOLONE
SpectraBase Compound ID 7LOzemWn4MN
InChI InChI=1S/C24H26BrNO2/c1-2-3-6-17-28-21-13-10-19(11-14-21)9-12-20-18-24(27)22-7-4-5-8-23(22)26(20)16-15-25/h4-5,7-14,18H,2-3,6,15-17H2,1H3/b12-9+
InChIKey IRRQOPDYKZGVOO-FMIVXFBMSA-N
Mol Weight 440.38 g/mol
Molecular Formula C24H26BrNO2
Exact Mass 439.114692 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HPro4NtGNbS
Name 1-(2-BROMOETHYL)-2-[(1'E)-(4''-PENTOXYPHENYL)-ETHENYL]-4(1H)-QUINOLONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26BrNO2
InChI InChI=1S/C24H26BrNO2/c1-2-3-6-17-28-21-13-10-19(11-14-21)9-12-20-18-24(27)22-7-4-5-8-23(22)26(20)16-15-25/h4-5,7-14,18H,2-3,6,15-17H2,1H3/b12-9+
InChIKey IRRQOPDYKZGVOO-FMIVXFBMSA-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 440.380 g/mol
Solvent CDCl3
Source File Reference UWIR15361