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Succinic acid, 2,3-dichlorophenyl 2,4,5-trichlorophenyl ester

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Succinic acid, 2,3-dichlorophenyl 2,4,5-trichlorophenyl ester
SpectraBase Compound ID DShDFKU3M0U
InChI InChI=1S/C16H9Cl5O4/c17-8-2-1-3-12(16(8)21)24-14(22)4-5-15(23)25-13-7-10(19)9(18)6-11(13)20/h1-3,6-7H,4-5H2
InChIKey XIKZQZRRXIQPNI-UHFFFAOYSA-N
Mol Weight 442.5 g/mol
Molecular Formula C16H9Cl5O4
Exact Mass 439.894347 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8a9lSZ2VUbI
Name Succinic acid, 2,3-dichlorophenyl 2,4,5-trichlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 439.894347266 u
Formula C16H9Cl5O4
InChI InChI=1S/C16H9Cl5O4/c17-8-2-1-3-12(16(8)21)24-14(22)4-5-15(23)25-13-7-10(19)9(18)6-11(13)20/h1-3,6-7H,4-5H2
InChIKey XIKZQZRRXIQPNI-UHFFFAOYSA-N
Molecular Weight 442.509 g/mol
SMILES C(CC(OC1=C(C(=CC=C1)Cl)Cl)=O)C(OC=1C(=CC(=C(C1)Cl)Cl)Cl)=O