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Glutaric acid, 2,2-dichloroethyl heptadecyl ester
SpectraBase Compound ID HPMVg6cZ8fa
InChI InChI=1S/C24H44Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-29-23(27)18-17-19-24(28)30-21-22(25)26/h22H,2-21H2,1H3
InChIKey NMIVVLWFQRBTES-UHFFFAOYSA-N
Mol Weight 467.5 g/mol
Molecular Formula C24H44Cl2O4
Exact Mass 466.261665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FD8R2gYrCdd
Name Glutaric acid, 2,2-dichloroethyl heptadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 466.261665293 u
Formula C24H44Cl2O4
InChI InChI=1S/C24H44Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-29-23(27)18-17-19-24(28)30-21-22(25)26/h22H,2-21H2,1H3
InChIKey NMIVVLWFQRBTES-UHFFFAOYSA-N
Molecular Weight 467.518 g/mol
SMILES C(CCC(OCC(Cl)Cl)=O)C(OCCCCCCCCCCCCCCCCC)=O