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Glutaric acid, 2,4,6-trichlorophenyl 2,4-dichlorophenyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,4,6-trichlorophenyl 2,4-dichlorophenyl ester
SpectraBase Compound ID 4tYKJDYXfwm
InChI InChI=1S/C17H11Cl5O4/c18-9-4-5-14(11(20)6-9)25-15(23)2-1-3-16(24)26-17-12(21)7-10(19)8-13(17)22/h4-8H,1-3H2
InChIKey IUKCCWJOFBLWIU-UHFFFAOYSA-N
Mol Weight 456.5 g/mol
Molecular Formula C17H11Cl5O4
Exact Mass 453.909997 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 54K5eY6FijP
Name Glutaric acid, 2,4,6-trichlorophenyl 2,4-dichlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 453.909997330 u
Formula C17H11Cl5O4
InChI InChI=1S/C17H11Cl5O4/c18-9-4-5-14(11(20)6-9)25-15(23)2-1-3-16(24)26-17-12(21)7-10(19)8-13(17)22/h4-8H,1-3H2
InChIKey IUKCCWJOFBLWIU-UHFFFAOYSA-N
Molecular Weight 456.536 g/mol
SMILES C(CCC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC=1C(=CC(=CC1)Cl)Cl)=O