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Ricinelaidate <methyl->
SpectraBase Compound ID H3bbStqO7TN
InChI InChI=1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10+/t18-/m1/s1
InChIKey XKGDWZQXVZSXAO-LVMGUKCRSA-N
Mol Weight 312.5 g/mol
Molecular Formula C19H36O3
Exact Mass 312.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kz2jDqDjb24
Name Ricinelaidate
CAS Registry Number 7706-01-6
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O3
InChI InChI=1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10+/t18-/m1/s1
InChIKey XKGDWZQXVZSXAO-LVMGUKCRSA-N
Number of Peaks 229
RI2 2381
RI4 2293
RI5 1965
SMILES C(CCCCCCC\C=C\C[C@@](CCCCCC)(O)[H])(=O)OC
SPLASH splash10-05u2-9400000000-37a3201e52b304ceb56a
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 9-Octadecenoic acid, 12-hydroxy-, methyl ester, (9E,12R)- Me. 12-OH C18:1n9
Wiley ID LM_LIPIDS2016_196