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Terephthalic acid, di(2-ethylcyclohexyl) ester

View entire compound with spectra: 1 NMR

Terephthalic acid, di(2-ethylcyclohexyl) ester
SpectraBase Compound ID G4ND24eTCYE
InChI InChI=1S/C24H34O4/c1-3-17-9-5-7-11-21(17)27-23(25)19-13-15-20(16-14-19)24(26)28-22-12-8-6-10-18(22)4-2/h13-18,21-22H,3-12H2,1-2H3
InChIKey INVMEVOZZSBCKM-UHFFFAOYSA-N
Mol Weight 386.5 g/mol
Molecular Formula C24H34O4
Exact Mass 386.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A98yX66l9WN
Name Terephthalic acid, di(2-ethylcyclohexyl) ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.245709571 u
Formula C24H34O4
InChI InChI=1S/C24H34O4/c1-3-17-9-5-7-11-21(17)27-23(25)19-13-15-20(16-14-19)24(26)28-22-12-8-6-10-18(22)4-2/h13-18,21-22H,3-12H2,1-2H3
InChIKey INVMEVOZZSBCKM-UHFFFAOYSA-N
Molecular Weight 386.532 g/mol
SMILES CCC1CCCCC1OC(C1=CC=C(C=C1)C(OC1CCCCC1CC)=O)=O