For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Phthalic acid, 2-cyclohexylethyl isobutyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-cyclohexylethyl isobutyl ester
SpectraBase Compound ID Izn5DNTsUux
InChI InChI=1S/C20H28O4/c1-15(2)14-24-20(22)18-11-7-6-10-17(18)19(21)23-13-12-16-8-4-3-5-9-16/h6-7,10-11,15-16H,3-5,8-9,12-14H2,1-2H3
InChIKey FYTFJGFRPMBYNJ-UHFFFAOYSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID ESab3MjGwr3
Name Phthalic acid, 2-cyclohexylethyl isobutyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.198759378 u
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-15(2)14-24-20(22)18-11-7-6-10-17(18)19(21)23-13-12-16-8-4-3-5-9-16/h6-7,10-11,15-16H,3-5,8-9,12-14H2,1-2H3
InChIKey FYTFJGFRPMBYNJ-UHFFFAOYSA-N
Molecular Weight 332.440 g/mol
SMILES C1=C(C(=CC=C1)C(=O)OCC(C)C)C(=O)OCCC1CCCCC1