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Decanoic acid methyl ester
SpectraBase Compound ID 5wIvwXOFx6W
InChI InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3
InChIKey YRHYCMZPEVDGFQ-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYiEOfdL355
Name Methyl decanoate
CAS Registry Number 110-42-9
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 186.161979946 u
Formula C11H22O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3
InChIKey YRHYCMZPEVDGFQ-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
Nominal Mass 186 u
Number of Peaks 104
SMILES CCCCCCCCCC(OC)=O
SPLASH splash10-00dl-9000000000-6eff044195ff2d8a7d8b
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001876