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Glutaric acid, 2-(2,4-dichlorophenyl)ethyl octyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-(2,4-dichlorophenyl)ethyl octyl ester
SpectraBase Compound ID 7m0HGZBEa9K
InChI InChI=1S/C21H30Cl2O4/c1-2-3-4-5-6-7-14-26-20(24)9-8-10-21(25)27-15-13-17-11-12-18(22)16-19(17)23/h11-12,16H,2-10,13-15H2,1H3
InChIKey KPQHJXOPNSXMRO-UHFFFAOYSA-N
Mol Weight 417.37 g/mol
Molecular Formula C21H30Cl2O4
Exact Mass 416.152115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59L1jnaPCEO
Name Glutaric acid, 2-(2,4-dichlorophenyl)ethyl octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 416.152114842 u
Formula C21H30Cl2O4
InChI InChI=1S/C21H30Cl2O4/c1-2-3-4-5-6-7-14-26-20(24)9-8-10-21(25)27-15-13-17-11-12-18(22)16-19(17)23/h11-12,16H,2-10,13-15H2,1H3
InChIKey KPQHJXOPNSXMRO-UHFFFAOYSA-N
Molecular Weight 417.373 g/mol
SMILES C(OCCC1=CC=C(C=C1Cl)Cl)(=O)CCCC(OCCCCCCCC)=O