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

*Links on SpectraBase are not permalinks.

Phthalic acid, 2-acethylphenyl octyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-acethylphenyl octyl ester
SpectraBase Compound ID DU8MvOGhrUd
InChI InChI=1S/C24H28O5/c1-3-4-5-6-7-12-17-28-23(26)20-14-8-9-15-21(20)24(27)29-22-16-11-10-13-19(22)18(2)25/h8-11,13-16H,3-7,12,17H2,1-2H3
InChIKey WOOCYAYGLWPJNW-UHFFFAOYSA-N
Mol Weight 396.48 g/mol
Molecular Formula C24H28O5
Exact Mass 396.193674 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 9QskjxMqcRM
Name Phthalic acid, 2-acethylphenyl octyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.193673997 u
Formula C24H28O5
InChI InChI=1S/C24H28O5/c1-3-4-5-6-7-12-17-28-23(26)20-14-8-9-15-21(20)24(27)29-22-16-11-10-13-19(22)18(2)25/h8-11,13-16H,3-7,12,17H2,1-2H3
InChIKey WOOCYAYGLWPJNW-UHFFFAOYSA-N
Molecular Weight 396.483 g/mol
SMILES CCCCCCCCOC(C1=C(C=CC=C1)C(=O)OC1=CC=CC=C1C(=O)C)=O