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Succinic acid, 2,4,6-trichlorophenyl 2-ethylphenyl ester

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Succinic acid, 2,4,6-trichlorophenyl 2-ethylphenyl ester
SpectraBase Compound ID 65bE79BWAnV
InChI InChI=1S/C18H15Cl3O4/c1-2-11-5-3-4-6-15(11)24-16(22)7-8-17(23)25-18-13(20)9-12(19)10-14(18)21/h3-6,9-10H,2,7-8H2,1H3
InChIKey GTIVWGRVASAIBT-UHFFFAOYSA-N
Mol Weight 401.67 g/mol
Molecular Formula C18H15Cl3O4
Exact Mass 400.003592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KGD0v4oXhK3
Name Succinic acid, 2,4,6-trichlorophenyl 2-ethylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 400.003592059 u
Formula C18H15Cl3O4
InChI InChI=1S/C18H15Cl3O4/c1-2-11-5-3-4-6-15(11)24-16(22)7-8-17(23)25-18-13(20)9-12(19)10-14(18)21/h3-6,9-10H,2,7-8H2,1H3
InChIKey GTIVWGRVASAIBT-UHFFFAOYSA-N
Molecular Weight 401.673 g/mol
SMILES C(CC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC=1C(CC)=CC=CC1)=O