For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-HEXANOYL-5-CARBOXY-CYClOHEXANE-1,3-DIONE
SpectraBase Compound ID KigU3L1ApmG
InChI InChI=1S/C13H18O5/c1-2-3-4-5-9(14)12-10(15)6-8(13(17)18)7-11(12)16/h8,12H,2-7H2,1H3,(H,17,18)
InChIKey GMIBSRSGPPROEH-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6qAyJSJs6nn
Name 2-HEXANOYL-5-CARBOXY-CYClOHEXANE-1,3-DIONE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-2-3-4-5-9(14)12-10(15)6-8(13(17)18)7-11(12)16/h8,12H,2-7H2,1H3,(H,17,18)
InChIKey GMIBSRSGPPROEH-UHFFFAOYSA-N
Literature Reference Author R.G.S.BROWN,L.YAN,M.H.BEALE,P.HEDDEN
Literature Reference Citation PHYTOCHEM.,47,679(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00575-X
Molecular Weight 254.283 g/mol
Solvent CDCl3
Source File Reference UWMS218