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(S)-3-Hydroxytetradecanoate <methyl->
SpectraBase Compound ID BiDlDnY7hhL
InChI InChI=1S/C15H30O3/c1-3-4-5-6-7-8-9-10-11-12-14(16)13-15(17)18-2/h14,16H,3-13H2,1-2H3/t14-/m0/s1
InChIKey UOZZAMWODZQSOA-AWEZNQCLSA-N
Mol Weight 258.4 g/mol
Molecular Formula C15H30O3
Exact Mass 258.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRkkJYiCDrI
Name (S)-3-Hydroxytetradecanoate
CAS Registry Number 76835-67-1
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 258.219494823 u
Formula C15H30O3
InChI InChI=1S/C15H30O3/c1-3-4-5-6-7-8-9-10-11-12-14(16)13-15(17)18-2/h14,16H,3-13H2,1-2H3/t14-/m0/s1
InChIKey UOZZAMWODZQSOA-AWEZNQCLSA-N
Molecular Weight 258.402 g/mol
Number of Peaks 168
RI2 1884
RI4 1870
RI5 1547
SMILES O[C@](CC(=O)OC)(CCCCCCCCCCC)[H]
SPLASH splash10-0udi-9700000000-550a1b49fa66bab1b072
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 Tetradecanoic acid, 3-hydroxy-, methyl ester, (3S)- Me. 3-OH (S) C14:0
Wiley ID LM_LIPIDS2016_187