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Glutaric acid, 2-ethylhexyl 2,4-dichlorophenyl ester

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Glutaric acid, 2-ethylhexyl 2,4-dichlorophenyl ester
SpectraBase Compound ID KKf4hdNsD5b
InChI InChI=1S/C19H26Cl2O4/c1-3-5-7-14(4-2)13-24-18(22)8-6-9-19(23)25-17-11-10-15(20)12-16(17)21/h10-12,14H,3-9,13H2,1-2H3
InChIKey UCCVGRDNBBLKGU-UHFFFAOYSA-N
Mol Weight 389.32 g/mol
Molecular Formula C19H26Cl2O4
Exact Mass 388.120815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPOSXolIxRS
Name Glutaric acid, 2-ethylhexyl 2,4-dichlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 388.120814713 u
Formula C19H26Cl2O4
InChI InChI=1S/C19H26Cl2O4/c1-3-5-7-14(4-2)13-24-18(22)8-6-9-19(23)25-17-11-10-15(20)12-16(17)21/h10-12,14H,3-9,13H2,1-2H3
InChIKey UCCVGRDNBBLKGU-UHFFFAOYSA-N
Molecular Weight 389.319 g/mol
SMILES C(CCC(OCC(CC)CCCC)=O)C(OC=1C(=CC(=CC1)Cl)Cl)=O