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Glutaric acid, 2,2-dichloroethyl 4-(4-methoxyphenyl)cyclohexyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,2-dichloroethyl 4-(4-methoxyphenyl)cyclohexyl ester
SpectraBase Compound ID 9x3SyRKgncG
InChI InChI=1S/C20H26Cl2O5/c1-25-16-9-5-14(6-10-16)15-7-11-17(12-8-15)27-20(24)4-2-3-19(23)26-13-18(21)22/h5-6,9-10,15,17-18H,2-4,7-8,11-13H2,1H3
InChIKey OYEADKUAVDEVOD-UHFFFAOYSA-N
Mol Weight 417.33 g/mol
Molecular Formula C20H26Cl2O5
Exact Mass 416.115729 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3XFTwIGyeCK
Name Glutaric acid, 2,2-dichloroethyl 4-(4-methoxyphenyl)cyclohexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 416.115729332 u
Formula C20H26Cl2O5
InChI InChI=1S/C20H26Cl2O5/c1-25-16-9-5-14(6-10-16)15-7-11-17(12-8-15)27-20(24)4-2-3-19(23)26-13-18(21)22/h5-6,9-10,15,17-18H,2-4,7-8,11-13H2,1H3
InChIKey OYEADKUAVDEVOD-UHFFFAOYSA-N
Molecular Weight 417.329 g/mol
SMILES C(CCC(OCC(Cl)Cl)=O)C(OC1CCC(C2=CC=C(OC)C=C2)CC1)=O