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

*Links on SpectraBase are not permalinks.

Isophthalic acid, 2-ethylphenyl octyl ester

View entire compound with spectra: 1 NMR

Isophthalic acid, 2-ethylphenyl octyl ester
SpectraBase Compound ID 7uvuh45akx5
InChI InChI=1S/C24H30O4/c1-3-5-6-7-8-11-17-27-23(25)20-14-12-15-21(18-20)24(26)28-22-16-10-9-13-19(22)4-2/h9-10,12-16,18H,3-8,11,17H2,1-2H3
InChIKey DZRJEZMRWRORKZ-UHFFFAOYSA-N
Mol Weight 382.5 g/mol
Molecular Formula C24H30O4
Exact Mass 382.214409 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 Cf4Zk1FSZn4
Name Isophthalic acid, 2-ethylphenyl octyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 382.214409442 u
Formula C24H30O4
InChI InChI=1S/C24H30O4/c1-3-5-6-7-8-11-17-27-23(25)20-14-12-15-21(18-20)24(26)28-22-16-10-9-13-19(22)4-2/h9-10,12-16,18H,3-8,11,17H2,1-2H3
InChIKey DZRJEZMRWRORKZ-UHFFFAOYSA-N
Molecular Weight 382.500 g/mol
SMILES C1=CC(=CC(=C1)C(=O)OCCCCCCCC)C(OC1=C(CC)C=CC=C1)=O