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

*Links on SpectraBase are not permalinks.

Terephthalic acid, isobutyl tetradecyl ester

View entire compound with spectra: 1 NMR

Terephthalic acid, isobutyl tetradecyl ester
SpectraBase Compound ID 3bFwaEmwsxr
InChI InChI=1S/C26H42O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-20-29-25(27)23-16-18-24(19-17-23)26(28)30-21-22(2)3/h16-19,22H,4-15,20-21H2,1-3H3
InChIKey USSZIFUHJDZWSH-UHFFFAOYSA-N
Mol Weight 418.6 g/mol
Molecular Formula C26H42O4
Exact Mass 418.30831 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 9WbRVS5hIfT
Name Terephthalic acid, isobutyl tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.308309828 u
Formula C26H42O4
InChI InChI=1S/C26H42O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-20-29-25(27)23-16-18-24(19-17-23)26(28)30-21-22(2)3/h16-19,22H,4-15,20-21H2,1-3H3
InChIKey USSZIFUHJDZWSH-UHFFFAOYSA-N
Molecular Weight 418.618 g/mol
SMILES C1(=CC=C(C=C1)C(OCC(C)C)=O)C(OCCCCCCCCCCCCCC)=O