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1-METHYL-2-(1'-DODECYNYL)-4-(1H)-QUINOLONE
SpectraBase Compound ID EZoibOT4jge
InChI InChI=1S/C22H29NO/c1-3-4-5-6-7-8-9-10-11-12-15-19-18-22(24)20-16-13-14-17-21(20)23(19)2/h13-14,16-18H,3-11H2,1-2H3
InChIKey FTQUFWUWHRATNK-UHFFFAOYSA-N
Mol Weight 323.48 g/mol
Molecular Formula C22H29NO
Exact Mass 323.224915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DS6fWmhFvSQ
Name 1-METHYL-2-(1'-DODECYNYL)-4-(1H)-QUINOLONE
Compound Number 8N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO
InChI InChI=1S/C22H29NO/c1-3-4-5-6-7-8-9-10-11-12-15-19-18-22(24)20-16-13-14-17-21(20)23(19)2/h13-14,16-18H,3-11H2,1-2H3
InChIKey FTQUFWUWHRATNK-UHFFFAOYSA-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 323.478 g/mol
Sample ID 1049
Solvent CDCl3