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1,2-Cyclohexanedicarboxylic acid, hexyl 4-isopropyloxyphenyl diester

View entire compound with spectra: 1 NMR

1,2-Cyclohexanedicarboxylic acid, hexyl 4-isopropyloxyphenyl diester
SpectraBase Compound ID 2cvwsWA1gBS
InChI InChI=1S/C23H34O5/c1-4-5-6-9-16-26-22(24)20-10-7-8-11-21(20)23(25)28-19-14-12-18(13-15-19)27-17(2)3/h12-15,17,20-21H,4-11,16H2,1-3H3
InChIKey FEWHVLWUPPCEFJ-UHFFFAOYSA-N
Mol Weight 390.5 g/mol
Molecular Formula C23H34O5
Exact Mass 390.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 36yGAKgnrgt
Name 1,2-Cyclohexanedicarboxylic acid, hexyl 4-isopropyloxyphenyl diester
Comments Computed using HOSE algorithm
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Exact Mass 390.240624190 u
Formula C23H34O5
InChI InChI=1S/C23H34O5/c1-4-5-6-9-16-26-22(24)20-10-7-8-11-21(20)23(25)28-19-14-12-18(13-15-19)27-17(2)3/h12-15,17,20-21H,4-11,16H2,1-3H3
InChIKey FEWHVLWUPPCEFJ-UHFFFAOYSA-N
Molecular Weight 390.520 g/mol
SMILES CCCCCCOC(C1CCCCC1C(=O)OC1=CC=C(C=C1)OC(C)C)=O