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3-Hydroxytridecanoate <methyl->
SpectraBase Compound ID 6CmlUvDPeuU
InChI InChI=1S/C14H28O3/c1-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17-2/h13,15H,3-12H2,1-2H3
InChIKey MBIWBGYNTOAAKH-UHFFFAOYSA-N
Mol Weight 244.37 g/mol
Molecular Formula C14H28O3
Exact Mass 244.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1R7AiJ8lSPi
Name 3-Hydroxytridecanoate
CAS Registry Number 150024-70-7
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H28O3
InChI InChI=1S/C14H28O3/c1-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17-2/h13,15H,3-12H2,1-2H3
InChIKey MBIWBGYNTOAAKH-UHFFFAOYSA-N
Number of Peaks 164
RI2 1781
RI4 1768
RI5 1445
SMILES C(CC(CCCCCCCCCC)O)(=O)OC
SPLASH splash10-0udl-9500000000-1cfb9a054e5f8805522c
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Tridecanoic acid, 3-hydroxy-, methyl ester Me. 3-OH C13:0
Wiley ID LM_LIPIDS2016_186