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1-METHYL-2-[(5'E)-CYCLOHEPTYLIDENYLPENTYNYL]-4(1H)-QUINOLONE
SpectraBase Compound ID 60FlDIpPiiG
InChI InChI=1S/C22H29NO/c1-23-19(17-22(24)20-15-9-10-16-21(20)23)14-8-4-7-13-18-11-5-2-3-6-12-18/h9-10,13,15-17H,2-8,11-12,14H2,1H3
InChIKey NNDFMNQECFYVJC-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 EkOPGBKeD7I
Name 1-METHYL-2-[(5'E)-CYCLOHEPTYLIDENYLPENTYNYL]-4(1H)-QUINOLONE
Compound Number 31
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H29NO
InChI InChI=1S/C22H29NO/c1-23-19(17-22(24)20-15-9-10-16-21(20)23)14-8-4-7-13-18-11-5-2-3-6-12-18/h9-10,13,15-17H,2-8,11-12,14H2,1H3
InChIKey NNDFMNQECFYVJC-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 323.478 g/mol
Solvent CDCl3
Source File Reference UWIR15364