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3-Hydroxynonanoate <methyl->
SpectraBase Compound ID 3LUH2vENSFX
InChI InChI=1S/C10H20O3/c1-3-4-5-6-7-9(11)8-10(12)13-2/h9,11H,3-8H2,1-2H3
InChIKey KHCQOQFCKCGHHU-UHFFFAOYSA-N
Mol Weight 188.27 g/mol
Molecular Formula C10H20O3
Exact Mass 188.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44ul7wNeNn5
Name 3-Hydroxynonanoate
CAS Registry Number 83968-06-3
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O3
InChI InChI=1S/C10H20O3/c1-3-4-5-6-7-9(11)8-10(12)13-2/h9,11H,3-8H2,1-2H3
InChIKey KHCQOQFCKCGHHU-UHFFFAOYSA-N
Number of Peaks 121
RI2 1367
RI4 1359
RI5 1037
SMILES C(CC(CCCCCC)O)(=O)OC
SPLASH splash10-0ukc-9400000000-aca57c5017f86e9b0d7e
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Nonanoic acid, 3-hydroxy-, methyl ester Me. 3-OH C9:0
Wiley ID LM_LIPIDS2016_184