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3-BETA-ACETOXY-4-BETA-HYDROXY-PALLENONE
SpectraBase Compound ID 7IqiPCNFN7I
InChI InChI=1S/C17H28O4/c1-9(2)12(7-6-10(3)18)15-13-8-14(21-11(4)19)17(5,20)16(13)15/h9,12-16,20H,6-8H2,1-5H3/t12-,13-,14-,15-,16-,17-/m0/s1
InChIKey JXZSGIRGRXOPRC-UYLCUJDWSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIzbLndotH7
Name 3-BETA-ACETOXY-4-BETA-HYDROXY-PALLENONE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-9(2)12(7-6-10(3)18)15-13-8-14(21-11(4)19)17(5,20)16(13)15/h9,12-16,20H,6-8H2,1-5H3/t12-,13-,14-,15-,16-,17-/m0/s1
InChIKey JXZSGIRGRXOPRC-UYLCUJDWSA-N
Literature Reference Author G.APPENDINO,J.JAKUPOVIC,S.JAKUPOVIC
Literature Reference Citation PHYTOCHEM.,46,1039(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00386-5
Molecular Weight 296.407 g/mol
Sample ID 65438
Solvent CDCl3