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Succinic acid, 2,4,6-trichlorophenyl cis-4-methylcyclohexyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 2,4,6-trichlorophenyl cis-4-methylcyclohexyl ester
SpectraBase Compound ID 9DpDXOAYQuF
InChI InChI=1S/C17H19Cl3O4/c1-10-2-4-12(5-3-10)23-15(21)6-7-16(22)24-17-13(19)8-11(18)9-14(17)20/h8-10,12H,2-7H2,1H3
InChIKey UVCNMCFHMNDXEK-UHFFFAOYSA-N
Mol Weight 393.69 g/mol
Molecular Formula C17H19Cl3O4
Exact Mass 392.034892 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Ecav6BD2Br
Name Succinic acid, 2,4,6-trichlorophenyl cis-4-methylcyclohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 392.034892188 u
Formula C17H19Cl3O4
InChI InChI=1S/C17H19Cl3O4/c1-10-2-4-12(5-3-10)23-15(21)6-7-16(22)24-17-13(19)8-11(18)9-14(17)20/h8-10,12H,2-7H2,1H3
InChIKey UVCNMCFHMNDXEK-UHFFFAOYSA-N
Molecular Weight 393.694 g/mol
SMILES C(CC(OC1=C(C=C(C=C1Cl)Cl)Cl)=O)C(OC1CCC(C)CC1)=O