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methyl 11-((5-methoxy-3-methyl-5-oxopentyl)oxy)undecanoate
SpectraBase Compound ID IpW2mgh2fqX
InChI InChI=1S/C19H36O5/c1-17(16-19(21)23-3)13-15-24-14-11-9-7-5-4-6-8-10-12-18(20)22-2/h17H,4-16H2,1-3H3
InChIKey HBNLYNGTFKCHKP-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C19H36O5
Exact Mass 344.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 547G0PvyxZa
Name methyl 11-((5-methoxy-3-methyl-5-oxopentyl)oxy)undecanoate
Appearance Pale yellow oil
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Exact Mass 344.256274254 u
Formula C19H36O5
InChI InChI=1S/C19H36O5/c1-17(16-19(21)23-3)13-15-24-14-11-9-7-5-4-6-8-10-12-18(20)22-2/h17H,4-16H2,1-3H3
InChIKey HBNLYNGTFKCHKP-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 344.492 g/mol
Quality 276
SMILES COC(CCCCCCCCCCOCCC(CC(=O)OC)C)=O
SPLASH splash10-092a-7900000000-0ff17c34689b76c6f907
Source of Spectrum WO2023089158A1
Wiley ID 1897247