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Ethyl docosanoate
SpectraBase Compound ID GkiCSj2MewB
InChI InChI=1S/C24H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-4-2/h3-23H2,1-2H3
InChIKey JIZCYLOUIAIZHQ-UHFFFAOYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C24H48O2
Exact Mass 368.365431 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JSrBiV2TzRN
Name Behenate
CAS Registry Number 5908-87-2
Classification Fatty esters; Fatty acid ethyl 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 368.365430784 u
Formula C24H48O2
InChI InChI=1S/C24H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-4-2/h3-23H2,1-2H3
InChIKey JIZCYLOUIAIZHQ-UHFFFAOYSA-N
Molecular Weight 368.646 g/mol
Number of Peaks 50
RI2 2234
RI4 2593
RI5 2266
SMILES C(CCCCCCCCCCCCCCCCCCCCC)(=O)OCC
SPLASH splash10-052u-9200000000-5efd320f9fa899df2e12
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 Docosanoic acid, ethyl ester Et. C22:0
Wiley ID LM_LIPIDS2016_105