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Dodecanoic acid, 11-methyl-, methyl ester

View entire compound with spectra: 5 MS (GC)

Dodecanoic acid, 11-methyl-, methyl ester
SpectraBase Compound ID G5lWwfS2Mn9
InChI InChI=1S/C14H28O2/c1-13(2)11-9-7-5-4-6-8-10-12-14(15)16-3/h13H,4-12H2,1-3H3
InChIKey GSRXTORWPQDOOY-UHFFFAOYSA-N
Mol Weight 228.38 g/mol
Molecular Formula C14H28O2
Exact Mass 228.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dt2Ej0IqG
Name Methyl 11-methyldodecanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.208930140 u
Formula C14H28O2
InChI InChI=1S/C14H28O2/c1-13(2)11-9-7-5-4-6-8-10-12-14(15)16-3/h13H,4-12H2,1-3H3
InChIKey GSRXTORWPQDOOY-UHFFFAOYSA-N
Instrument Name HP 5973-6890
Ionization Type EI
Literature Reference DOI 10.1002/anie.201611940
Molecular Weight 228.376 g/mol
Quality 585
SMILES COC(CCCCCCCCCC(C)C)=O
SPLASH splash10-059f-9200000000-296c4305fbb1fcffc7c6
Source of Spectrum ACI-56-SM36-41 (DOI: 10.1002/anie.201611940)
Wiley ID 1895657