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Xestodecalactone B

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Xestodecalactone B
SpectraBase Compound ID 6ewpKPpHbjy
InChI InChI=1S/C14H16O6/c1-7-2-9(15)5-11(17)14-8(4-13(19)20-7)3-10(16)6-12(14)18/h3,6-7,9,15-16,18H,2,4-5H2,1H3/t7-,9+/m0/s1
InChIKey OESLECARYLNMSC-IONNQARKSA-N
Mol Weight 280.28 g/mol
Molecular Formula C14H16O6
Exact Mass 280.094688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3v3iHQdI108
Name XESTODECALACTONE-B
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O6
InChI InChI=1S/C14H16O6/c1-7-2-9(15)5-11(17)14-8(4-13(19)20-7)3-10(16)6-12(14)18/h3,6-7,9,15-16,18H,2,4-5H2,1H3/t7-,9+/m0/s1
InChIKey OESLECARYLNMSC-IONNQARKSA-N
Literature Reference Author R.A.EDRADA,M.HEUBES,G.BRAUERS,V.WRAY,A.BERG,U.GRAEFE,M.WOHLF ARTH,J.MUEHLBACHER,K
Literature Reference Citation J.NAT.PROD.,65,1598(2002)
Literature Reference DOI 10.1021/np020085c
Molecular Weight 280.277 g/mol
Solvent DMSO-D6
Source File Reference UWSI7183