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Succinic acid, 4-chloro-3-methylphenyl cis-4-methylcyclohexyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 4-chloro-3-methylphenyl cis-4-methylcyclohexyl ester
SpectraBase Compound ID CEmhM3uDU6F
InChI InChI=1S/C18H23ClO4/c1-12-3-5-14(6-4-12)22-17(20)9-10-18(21)23-15-7-8-16(19)13(2)11-15/h7-8,11-12,14H,3-6,9-10H2,1-2H3
InChIKey YJONPWCLHGBIOL-UHFFFAOYSA-N
Mol Weight 338.83 g/mol
Molecular Formula C18H23ClO4
Exact Mass 338.128487 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CwDcDQiYnbK
Name Succinic acid, 4-chloro-3-methylphenyl cis-4-methylcyclohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 338.128486917 u
Formula C18H23ClO4
InChI InChI=1S/C18H23ClO4/c1-12-3-5-14(6-4-12)22-17(20)9-10-18(21)23-15-7-8-16(19)13(2)11-15/h7-8,11-12,14H,3-6,9-10H2,1-2H3
InChIKey YJONPWCLHGBIOL-UHFFFAOYSA-N
Molecular Weight 338.831 g/mol
SMILES C(CC(OC1=CC(C)=C(C=C1)Cl)=O)C(OC1CCC(C)CC1)=O