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1-CYCLOPROPYL-2-[(E)-13-BROMOTRIDEC-1'-ENYL]-4-(1H)-QUINOLONE
SpectraBase Compound ID GGg6qxsk0Wl
InChI InChI=1S/C25H34BrNO/c26-19-13-9-7-5-3-1-2-4-6-8-10-14-22-20-25(28)23-15-11-12-16-24(23)27(22)21-17-18-21/h10-12,14-16,20-21H,1-9,13,17-19H2/b14-10+
InChIKey DBYMJUREXFDKNY-GXDHUFHOSA-N
Mol Weight 444.5 g/mol
Molecular Formula C25H34BrNO
Exact Mass 443.182378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnHRIaYUMno
Name 1-CYCLOPROPYL-2-[(E)-13-BROMOTRIDEC-1'-ENYL]-4-(1H)-QUINOLONE
Compound Number 18B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H34BrNO
InChI InChI=1S/C25H34BrNO/c26-19-13-9-7-5-3-1-2-4-6-8-10-14-22-20-25(28)23-15-11-12-16-24(23)27(22)21-17-18-21/h10-12,14-16,20-21H,1-9,13,17-19H2/b14-10+
InChIKey DBYMJUREXFDKNY-GXDHUFHOSA-N
Literature Reference Author A.WUBE,J.D.GUZMAN,A.HUFNER,C.HOCHFELLNER,M.BLUNDER,R.BAUER,S .GIBBONS,S.BHAKTA,F.
Literature Reference Citation MOLECULES,17,8217(2012)
Literature Reference DOI 10.3390/molecules17078217
Molecular Weight 444.455 g/mol
Sample ID 1057
Solvent CDCl3