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Methyl 9-methylundecanoate
SpectraBase Compound ID 2PJyZBUOY0x
InChI InChI=1S/C13H26O2/c1-4-12(2)10-8-6-5-7-9-11-13(14)15-3/h12H,4-11H2,1-3H3
InChIKey DVWAVFSGXPEYML-UHFFFAOYSA-N
Mol Weight 214.35 g/mol
Molecular Formula C13H26O2
Exact Mass 214.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1SRVgIT3bV
Name 9-methylundecanoate
CAS Registry Number 5569-52-8
Classification Fatty esters; Fatty acid methyl esters
Copyright Copyright © 2016-2024  John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H26O2
InChI InChI=1S/C13H26O2/c1-4-12(2)10-8-6-5-7-9-11-13(14)15-3/h12H,4-11H2,1-3H3
InChIKey DVWAVFSGXPEYML-UHFFFAOYSA-N
Number of Peaks 50
RI2 1176
RI4 1492
RI5 1172
SMILES C(CCCCCCCC(CC)C)(=O)OC
SPLASH splash10-060c-9200000000-ba518e8ee86a4c90f41c
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Undecanoic acid, 9-methyl-, methyl ester Me. C12:0 anteiso
Wiley ID LM_LIPIDS2016_154