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1,2-Cyclohexanedicarboxylic acid, butyl 2,5-dichlorophenyl ester

View entire compound with spectra: 1 NMR

1,2-Cyclohexanedicarboxylic acid, butyl 2,5-dichlorophenyl ester
SpectraBase Compound ID C2EXbxLdqV7
InChI InChI=1S/C18H22Cl2O4/c1-2-3-10-23-17(21)13-6-4-5-7-14(13)18(22)24-16-11-12(19)8-9-15(16)20/h8-9,11,13-14H,2-7,10H2,1H3
InChIKey OLZMJJFEDMHOJM-UHFFFAOYSA-N
Mol Weight 373.28 g/mol
Molecular Formula C18H22Cl2O4
Exact Mass 372.089515 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HO7PxEssbsT
Name 1,2-Cyclohexanedicarboxylic acid, butyl 2,5-dichlorophenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 372.089514584 u
Formula C18H22Cl2O4
InChI InChI=1S/C18H22Cl2O4/c1-2-3-10-23-17(21)13-6-4-5-7-14(13)18(22)24-16-11-12(19)8-9-15(16)20/h8-9,11,13-14H,2-7,10H2,1H3
InChIKey OLZMJJFEDMHOJM-UHFFFAOYSA-N
Molecular Weight 373.276 g/mol
SMILES C(C1CCCCC1C(OCCCC)=O)(=O)OC1=CC(=CC=C1Cl)Cl