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PATAGONIC-ACID-METHYLESTER
SpectraBase Compound ID KlymWyMnNIr
InChI InChI=1S/C21H30O4/c1-14-8-11-21(3)16(19(23)24-4)6-5-7-17(21)20(14,2)12-9-15-10-13-25-18(15)22/h6,10,14,17H,5,7-9,11-13H2,1-4H3/t14-,17-,20+,21+/m1/s1
InChIKey SIFADWAWFOYYKC-LPNJYYIDSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2zDxUwEsMHO
Name 16-OXO-15,16-H-HARDWIKIIC-ACID-METHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-14-8-11-21(3)16(19(23)24-4)6-5-7-17(21)20(14,2)12-9-15-10-13-25-18(15)22/h6,10,14,17H,5,7-9,11-13H2,1-4H3/t14-,17-,20+,21+/m1/s1
InChIKey SIFADWAWFOYYKC-LPNJYYIDSA-N
Literature Reference Author D.AVILA,J.D.MEDINA,A.J.DEEMING
Literature Reference Citation J.NAT.PROD.,55,845(1992)
Literature Reference DOI 10.1021/np50085a002
Molecular Weight 346.467 g/mol
Solvent CDCl3
Source File Reference UWCS5804