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Hexanoic acid, 3-hydroxy-, methyl ester
SpectraBase Compound ID B1tn566FTOU
InChI InChI=1S/C7H14O3/c1-3-4-6(8)5-7(9)10-2/h6,8H,3-5H2,1-2H3
InChIKey ACCRBMDJCPPJDX-UHFFFAOYSA-N
Mol Weight 146.19 g/mol
Molecular Formula C7H14O3
Exact Mass 146.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BihsNFgUJnW
Name 3-Hydroxyhexanoate
CAS Registry Number 21188-58-9
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O3
InChI InChI=1S/C7H14O3/c1-3-4-6(8)5-7(9)10-2/h6,8H,3-5H2,1-2H3
InChIKey ACCRBMDJCPPJDX-UHFFFAOYSA-N
Number of Peaks 50
RI2 1058
RI4 1050
RI5 722
SMILES C(CC(CCC)O)(=O)OC
SPLASH splash10-0fkc-9200000000-80afb6868e04906cb223
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Hexanoic acid, 3-hydroxy-, methyl ester Me. 3-OH C6:1
Wiley ID LM_LIPIDS2016_183