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Succinic acid, dec-2-yl 2,4,6-trichlorophenyl ester
SpectraBase Compound ID 28n3EMiQONu
InChI InChI=1S/C20H27Cl3O4/c1-3-4-5-6-7-8-9-14(2)26-18(24)10-11-19(25)27-20-16(22)12-15(21)13-17(20)23/h12-14H,3-11H2,1-2H3
InChIKey GYMVMYMLBTVQOQ-UHFFFAOYSA-N
Mol Weight 437.79 g/mol
Molecular Formula C20H27Cl3O4
Exact Mass 436.097492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L6LtHhpudfr
Name Succinic acid, dec-2-yl 2,4,6-trichlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 436.097492445 u
Formula C20H27Cl3O4
InChI InChI=1S/C20H27Cl3O4/c1-3-4-5-6-7-8-9-14(2)26-18(24)10-11-19(25)27-20-16(22)12-15(21)13-17(20)23/h12-14H,3-11H2,1-2H3
InChIKey GYMVMYMLBTVQOQ-UHFFFAOYSA-N
Molecular Weight 437.791 g/mol
SMILES C(CC(OC(C)CCCCCCCC)=O)C(OC1=C(C=C(C=C1Cl)Cl)Cl)=O