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METHYL-(11R,12S,13S,9Z,15Z)-13-HYDROXY-11,12-(ISOPROPYLIDENEDIOXY)-OCTADECA-9,15-DIENOATE
SpectraBase Compound ID BQrsDvWkq0W
InChI InChI=1S/C22H38O5/c1-5-6-12-15-18(23)21-19(26-22(2,3)27-21)16-13-10-8-7-9-11-14-17-20(24)25-4/h6,12-13,16,18-19,21,23H,5,7-11,14-15,17H2,1-4H3/b12-6-,16-13-
InChIKey HXKKOMUNQLJQLS-JUAAURBQSA-N
Mol Weight 382.5 g/mol
Molecular Formula C22H38O5
Exact Mass 382.271924 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 78tV9AiniL3
Name METHYL-(11R,12S,13S,9Z,15Z)-13-HYDROXY-11,12-(ISOPROPYLIDENEDIOXY)-OCTADECA-9,15-DIENOATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H38O5
InChI InChI=1S/C22H38O5/c1-5-6-12-15-18(23)21-19(26-22(2,3)27-21)16-13-10-8-7-9-11-14-17-20(24)25-4/h6,12-13,16,18-19,21,23H,5,7-11,14-15,17H2,1-4H3/b12-6-,16-13-
InChIKey HXKKOMUNQLJQLS-JUAAURBQSA-N
Literature Reference Author A.BAUDAT,P.VOGEL
Literature Reference Citation HELV.CHIM.ACTA,77,1500(1994)
Literature Reference DOI 10.1002/hlca.19940770605
Molecular Weight 382.541 g/mol
Solvent CDCl3
Source File Reference UWPR360