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Glutaric acid, butyl octyl ester
SpectraBase Compound ID KygfTO17Mba
InChI InChI=1S/C17H32O4/c1-3-5-7-8-9-10-15-21-17(19)13-11-12-16(18)20-14-6-4-2/h3-15H2,1-2H3
InChIKey HUPRUAFBCOZKDU-UHFFFAOYSA-N
Mol Weight 300.4 g/mol
Molecular Formula C17H32O4
Exact Mass 300.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID YKAlYfhGN8
Name Glutaric acid, butyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 300.230059506 u
Formula C17H32O4
InChI InChI=1S/C17H32O4/c1-3-5-7-8-9-10-15-21-17(19)13-11-12-16(18)20-14-6-4-2/h3-15H2,1-2H3
InChIKey HUPRUAFBCOZKDU-UHFFFAOYSA-N
SMILES CCCCOC(CCCC(OCCCCCCCC)=O)=O