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4-HEXYL-6-PENTYL-CYCLOHEPT-4-EN-1,3-DIONE
SpectraBase Compound ID E899Y6NmS5y
InChI InChI=1S/C18H30O2/c1-3-5-7-9-11-16-13-18(20)14-17(19)12-15(16)10-8-6-4-2/h13,15H,3-12,14H2,1-2H3
InChIKey SQJODOUZDICWPG-UHFFFAOYSA-N
Mol Weight 278.44 g/mol
Molecular Formula C18H30O2
Exact Mass 278.22458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KF2oDij3lXR
Name 4-HEXYL-6-PENTYL-CYCLOHEPT-4-EN-1,3-DIONE
Compound Number 2 C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H30O2
InChI InChI=1S/C18H30O2/c1-3-5-7-9-11-16-13-18(20)14-17(19)12-15(16)10-8-6-4-2/h13,15H,3-12,14H2,1-2H3
InChIKey SQJODOUZDICWPG-UHFFFAOYSA-N
Literature Reference Author K.TAKEDA,Y.OHTANI
Literature Reference Citation ORG.LETTERS,1,677(1999)
Literature Reference DOI 10.1021/ol990764n
Molecular Weight 278.435 g/mol
Solvent CDCl3
Source File Reference UWSI26173