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Glutaric acid, tridec-2-en-1-yl 2-ethylbutyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, tridec-2-en-1-yl 2-ethylbutyl ester
SpectraBase Compound ID GNwmpBCZ4g0
InChI InChI=1S/C24H44O4/c1-4-7-8-9-10-11-12-13-14-15-16-20-27-23(25)18-17-19-24(26)28-21-22(5-2)6-3/h15-16,22H,4-14,17-21H2,1-3H3/b16-15+
InChIKey UTDVBEVHDKXBEU-FOCLMDBBSA-N
Mol Weight 396.6 g/mol
Molecular Formula C24H44O4
Exact Mass 396.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DT1IfMbAs2H
Name Glutaric acid, tridec-2-en-1-yl 2-ethylbutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 396.323959893 u
Formula C24H44O4
InChI InChI=1S/C24H44O4/c1-4-7-8-9-10-11-12-13-14-15-16-20-27-23(25)18-17-19-24(26)28-21-22(5-2)6-3/h15-16,22H,4-14,17-21H2,1-3H3/b16-15+
InChIKey UTDVBEVHDKXBEU-FOCLMDBBSA-N
Molecular Weight 396.612 g/mol
SMILES C(CCC(OC\C=C\CCCCCCCCCC)=O)C(OCC(CC)CC)=O