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

*Links on SpectraBase are not permalinks.
PESTALONE
SpectraBase Compound ID G0wqYg823Mc
InChI InChI=1S/C21H20Cl2O6/c1-9(2)5-6-11-13(25)7-14(26)12(8-24)15(11)19(27)16-20(28)17(22)10(3)18(23)21(16)29-4/h5,7-8,25-26,28H,6H2,1-4H3
InChIKey ACRANQNXYMAQKJ-UHFFFAOYSA-N
Mol Weight 439.29 g/mol
Molecular Formula C21H20Cl2O6
Exact Mass 438.063694 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 58MlJEopOcM
Name PESTALONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20Cl2O6
InChI InChI=1S/C21H20Cl2O6/c1-9(2)5-6-11-13(25)7-14(26)12(8-24)15(11)19(27)16-20(28)17(22)10(3)18(23)21(16)29-4/h5,7-8,25-26,28H,6H2,1-4H3
InChIKey ACRANQNXYMAQKJ-UHFFFAOYSA-N
Literature Reference Author M.CUETO,P.R.JENSEN,C.KAUFFMAN,W.FENICAL,E.LOBKOVSKY,J.CLARDY
Literature Reference Citation J.NAT.PROD.,64,1444(2001)
Literature Reference DOI 10.1021/np0102713
Molecular Weight 439.292 g/mol
Solvent ACETONE-D6
Source File Reference UWSI2316