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9,17-Octadecadiene-12,14-diyne-1,11,16-triol, 1-acetate
SpectraBase Compound ID 4zIF5JNQX6S
InChI InChI=1S/C20H28O4/c1-3-19(22)14-11-12-16-20(23)15-10-8-6-4-5-7-9-13-17-24-18(2)21/h3,10,15,19-20,22-23H,1,4-9,13,17H2,2H3/b15-10-/t19-,20-/m1/s1
InChIKey VVURZXYIXNNJCG-AWRVRSSQSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K9zGtwDKPtR
Name 9,17-OCTADECADIENE-12,14-DIYNE-1,11,16-TRIOL-1-ACETATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-3-19(22)14-11-12-16-20(23)15-10-8-6-4-5-7-9-13-17-24-18(2)21/h3,10,15,19-20,22-23H,1,4-9,13,17H2,2H3/b15-10-/t19-,20-/m1/s1
InChIKey VVURZXYIXNNJCG-AWRVRSSQSA-N
Literature Reference Author M.KOBAISY,Z.ABRAMOWSKI,L.LERMER,G.SAXENA,R.E.W.HANCOCK,G.H.N .TOWERS
Literature Reference Citation J.NAT.PROD.,60,1210(1997)
Literature Reference DOI 10.1021/np970182j
Molecular Weight 332.440 g/mol
Solvent CDCl3
Source File Reference UWCS21569