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1,2-Cyclohexanedicarboxylic acid, di(3-methylphenyl) ester

View entire compound with spectra: 1 NMR

1,2-Cyclohexanedicarboxylic acid, di(3-methylphenyl) ester
SpectraBase Compound ID HggcLL2mxzp
InChI InChI=1S/C22H24O4/c1-15-7-5-9-17(13-15)25-21(23)19-11-3-4-12-20(19)22(24)26-18-10-6-8-16(2)14-18/h5-10,13-14,19-20H,3-4,11-12H2,1-2H3
InChIKey NDSUOXWAUCFZEK-UHFFFAOYSA-N
Mol Weight 352.43 g/mol
Molecular Formula C22H24O4
Exact Mass 352.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HWZY3FwUxXS
Name 1,2-Cyclohexanedicarboxylic acid, di(3-methylphenyl) ester
Comments Computed using HOSE algorithm
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Exact Mass 352.167459249 u
Formula C22H24O4
InChI InChI=1S/C22H24O4/c1-15-7-5-9-17(13-15)25-21(23)19-11-3-4-12-20(19)22(24)26-18-10-6-8-16(2)14-18/h5-10,13-14,19-20H,3-4,11-12H2,1-2H3
InChIKey NDSUOXWAUCFZEK-UHFFFAOYSA-N
Molecular Weight 352.430 g/mol
SMILES C1(=CC(=CC=C1)C)OC(C1CCCCC1C(OC1=CC(C)=CC=C1)=O)=O