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(+)-3'-DECANOYL-CIS-KHELLACTONE
SpectraBase Compound ID 2X3oxSLBjLx
InChI InChI=1S/C24H32O6/c1-4-5-6-7-8-9-10-11-18(25)29-23-21(27)20-17(30-24(23,2)3)14-12-16-13-15-19(26)28-22(16)20/h12-15,21,23,27H,4-11H2,1-3H3/t21-,23-/m0/s1
InChIKey MVGSSLGEJSXBBZ-GMAHTHKFSA-N
Mol Weight 416.5 g/mol
Molecular Formula C24H32O6
Exact Mass 416.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KYyeaX5MFBR
Name (+)-3'-DECANOYL-CIS-KHELLACTONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H32O6
InChI InChI=1S/C24H32O6/c1-4-5-6-7-8-9-10-11-18(25)29-23-21(27)20-17(30-24(23,2)3)14-12-16-13-15-19(26)28-22(16)20/h12-15,21,23,27H,4-11H2,1-3H3/t21-,23-/m0/s1
InChIKey MVGSSLGEJSXBBZ-GMAHTHKFSA-N
Literature Reference Author J.WIDELSKI,E.MELLIOU,N.FOKIALAKIS,P.MAGIATIS,K.GLOWNIAK,I.CH INOU
Literature Reference Citation J.NAT.PROD.,68,1637(2005)
Literature Reference DOI 10.1021/np050209w
Molecular Weight 416.514 g/mol
Solvent CDCl3
Source File Reference UWMZ13079