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Undecanoic acid ethyl ester
SpectraBase Compound ID HlQLygeWkST
InChI InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3-12H2,1-2H3
InChIKey IAFQYUQIAOWKSB-UHFFFAOYSA-N
Mol Weight 214.35 g/mol
Molecular Formula C13H26O2
Exact Mass 214.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EmXW6rFHMdF
Name Undecanoate
Source of Sample SAFC Cat. #W349208
CAS Registry Number 627-90-7
Classification Fatty esters; Fatty acid ethyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O2
InChI InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3-12H2,1-2H3
InChIKey IAFQYUQIAOWKSB-UHFFFAOYSA-N
Number of Peaks 50
RI1 1485
RI2 1141
RI4 1498
RI5 1175
SMILES C(CCCCCCCCCC)(=O)OCC
SPLASH splash10-000l-9200000000-86c9d53e92bc9fac7faf
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Undecanoic acid, ethyl ester
Wiley ID LM_LIPIDS2016_365