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1,2-Cyclohexanedicarboxylic acid, 2-biphenyl ethyl ester

View entire compound with spectra: 1 NMR

1,2-Cyclohexanedicarboxylic acid, 2-biphenyl ethyl ester
SpectraBase Compound ID 2nN1cD1muOU
InChI InChI=1S/C22H24O4/c1-2-25-21(23)18-13-6-7-14-19(18)22(24)26-20-15-9-8-12-17(20)16-10-4-3-5-11-16/h3-5,8-12,15,18-19H,2,6-7,13-14H2,1H3
InChIKey GMZVCHXNGJYGBY-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 6Y8BsiTD3Lt
Name 1,2-Cyclohexanedicarboxylic acid, 2-biphenyl ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 352.167459249 u
Formula C22H24O4
InChI InChI=1S/C22H24O4/c1-2-25-21(23)18-13-6-7-14-19(18)22(24)26-20-15-9-8-12-17(20)16-10-4-3-5-11-16/h3-5,8-12,15,18-19H,2,6-7,13-14H2,1H3
InChIKey GMZVCHXNGJYGBY-UHFFFAOYSA-N
Molecular Weight 352.430 g/mol
SMILES C(C1CCCCC1C(=O)OC1=CC=CC=C1C1=CC=CC=C1)(OCC)=O