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Phthalic acid, di(2-(3-chlorophenyl)ethyl) ester

View entire compound with spectra: 1 NMR

Phthalic acid, di(2-(3-chlorophenyl)ethyl) ester
SpectraBase Compound ID HGlFfoI2pzh
InChI InChI=1S/C24H20Cl2O4/c25-19-7-3-5-17(15-19)11-13-29-23(27)21-9-1-2-10-22(21)24(28)30-14-12-18-6-4-8-20(26)16-18/h1-10,15-16H,11-14H2
InChIKey KHNJKNHMRGYYOX-UHFFFAOYSA-N
Mol Weight 443.33 g/mol
Molecular Formula C24H20Cl2O4
Exact Mass 442.073865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9q5RvqwsUV2
Name Phthalic acid, di(2-(3-chlorophenyl)ethyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 442.073864520 u
Formula C24H20Cl2O4
InChI InChI=1S/C24H20Cl2O4/c25-19-7-3-5-17(15-19)11-13-29-23(27)21-9-1-2-10-22(21)24(28)30-14-12-18-6-4-8-20(26)16-18/h1-10,15-16H,11-14H2
InChIKey KHNJKNHMRGYYOX-UHFFFAOYSA-N
Molecular Weight 443.326 g/mol
SMILES C(C1=CC=CC=C1C(OCCC1=CC=CC(=C1)Cl)=O)(OCCC1=CC=CC(=C1)Cl)=O