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

*Links on SpectraBase are not permalinks.

Phthalic acid, decyl 3,4-dimethylphenyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, decyl 3,4-dimethylphenyl ester
SpectraBase Compound ID 6cuhAnXc2n5
InChI InChI=1S/C26H34O4/c1-4-5-6-7-8-9-10-13-18-29-25(27)23-14-11-12-15-24(23)26(28)30-22-17-16-20(2)21(3)19-22/h11-12,14-17,19H,4-10,13,18H2,1-3H3
InChIKey RBKBGMBFUIZWMV-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C26H34O4
Exact Mass 410.24571 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 9LwikvqUXbm
Name Phthalic acid, decyl 3,4-dimethylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.245709571 u
Formula C26H34O4
InChI InChI=1S/C26H34O4/c1-4-5-6-7-8-9-10-13-18-29-25(27)23-14-11-12-15-24(23)26(28)30-22-17-16-20(2)21(3)19-22/h11-12,14-17,19H,4-10,13,18H2,1-3H3
InChIKey RBKBGMBFUIZWMV-UHFFFAOYSA-N
Molecular Weight 410.554 g/mol
SMILES C1(=CC=C(C(=C1)C)C)OC(C1=C(C(OCCCCCCCCCC)=O)C=CC=C1)=O