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VANILLYL-LINOLEATE;(9Z,12Z)-4-HYDROXY-3-METHOXYBENZYL-OCTADECA-9,12-DIENOATE
SpectraBase Compound ID BYvIn3UITK7
InChI InChI=1S/C26H40O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(28)30-22-23-19-20-24(27)25(21-23)29-2/h7-8,10-11,19-21,27H,3-6,9,12-18,22H2,1-2H3/b8-7-,11-10-
InChIKey ZFBHGGJCBVZNFN-NQLNTKRDSA-N
Mol Weight 416.6 g/mol
Molecular Formula C26H40O4
Exact Mass 416.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4tUy6iNP5OG
Name VANILLYL-LINOLEATE;(9Z,12Z)-4-HYDROXY-3-METHOXYBENZYL-OCTADECA-9,12-DIENOATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H40O4
InChI InChI=1S/C26H40O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(28)30-22-23-19-20-24(27)25(21-23)29-2/h7-8,10-11,19-21,27H,3-6,9,12-18,22H2,1-2H3/b8-7-,11-10-
InChIKey ZFBHGGJCBVZNFN-NQLNTKRDSA-N
Literature Reference Author J.ALENCAR,G.GOSSET,M.ROBIN,V.PIQUE,M.CULCASI,J.L.CLEMENT,A.M ERCIER,S.PIETRI
Literature Reference Citation J.AGR.FOOD.CHEM.,57,7311(2009)
Literature Reference DOI 10.1021/jf9010627
Molecular Weight 416.601 g/mol
Sample ID 68103
Solvent CDCl3