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Ethyl stearate
SpectraBase Compound ID 96mls5BWcrZ
InChI InChI=1S/C20H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h3-19H2,1-2H3
InChIKey MVLVMROFTAUDAG-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C20H40O2
Exact Mass 312.302831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcPxc8oAaH6
Name Stearate
CAS Registry Number 111-61-5
Classification Fatty esters; Fatty acid ethyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H40O2
InChI InChI=1S/C20H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h3-19H2,1-2H3
InChIKey MVLVMROFTAUDAG-UHFFFAOYSA-N
Number of Peaks 50
RI1 2182
RI2 1837
RI4 2192
RI5 1868
SMILES C(CCCCCCCCCCCCCCCCC)(=O)OCC
SPLASH splash10-052u-9200000000-5a56dd4fb7c2e3a661fa
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Octadecanoic acid, ethyl ester Et. C18:0
Wiley ID LM_LIPIDS2016_103