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5-HMR-LINOLEATE;(9Z,12Z)-3,5-DIHYDROXYBENZYL-OCTADECA-9,12-DIENOATE
SpectraBase Compound ID 6j1DY1o8lzx
InChI InChI=1S/C25H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(28)29-21-22-18-23(26)20-24(27)19-22/h6-7,9-10,18-20,26-27H,2-5,8,11-17,21H2,1H3/b7-6-,10-9-
InChIKey HNFDXIQJRBJNQT-HZJYTTRNSA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H38O4
Exact Mass 402.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ylYTp5Vf8S
Name 5-HMR-LINOLEATE;(9Z,12Z)-3,5-DIHYDROXYBENZYL-OCTADECA-9,12-DIENOATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H38O4
InChI InChI=1S/C25H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(28)29-21-22-18-23(26)20-24(27)19-22/h6-7,9-10,18-20,26-27H,2-5,8,11-17,21H2,1H3/b7-6-,10-9-
InChIKey HNFDXIQJRBJNQT-HZJYTTRNSA-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 402.574 g/mol
Sample ID 68105
Solvent DMSO-D6