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20-Hydroxyeicosanate <methyl->
SpectraBase Compound ID En5DL5va5Wu
InChI InChI=1S/C21H42O3/c1-24-21(23)19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22/h22H,2-20H2,1H3
InChIKey OCCHBWCFXPQLRX-UHFFFAOYSA-N
Mol Weight 342.6 g/mol
Molecular Formula C21H42O3
Exact Mass 342.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID COYw5YjcvCl
Name 20-Hydroxyeicosanate
CAS Registry Number 37477-29-5
Classification Fatty esters; Fatty acid methyl esters
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 342.313395209 u
Formula C21H42O3
InChI InChI=1S/C21H42O3/c1-24-21(23)19-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20-22/h22H,2-20H2,1H3
InChIKey OCCHBWCFXPQLRX-UHFFFAOYSA-N
Molecular Weight 342.564 g/mol
Number of Peaks 278
RI4 2623
RI5 2293
SMILES OCCCCCCCCCCCCCCCCCCCC(=O)OC
SPLASH splash10-05ug-9200000000-73d00343c4fa5203dd7c
Sample Comments RI1: measured on Equity-1 (Alkanes) RI2: measured on Supelcowax-10 (FAMEs) RI3: measured on Supelcowax-10 (FAEEs) RI4: measured on SLB-5ms (Alkanes) RI5: measured on SLB-5ms (FAMEs)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Eicosanoic acid, 20-hydroxy-, methyl ester Me. 20-OH C20:0
Wiley ID LM_LIPIDS2016_231