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

*Links on SpectraBase are not permalinks.

Phthalic acid, nonyl 1-phenylpropyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, nonyl 1-phenylpropyl ester
SpectraBase Compound ID 4SKkIeRwH3N
InChI InChI=1S/C26H34O4/c1-3-5-6-7-8-9-15-20-29-25(27)22-18-13-14-19-23(22)26(28)30-24(4-2)21-16-11-10-12-17-21/h10-14,16-19,24H,3-9,15,20H2,1-2H3
InChIKey PIRUYTXMLZAWFL-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 3UvyLhIGA8m
Name Phthalic acid, nonyl 1-phenylpropyl 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/c1-3-5-6-7-8-9-15-20-29-25(27)22-18-13-14-19-23(22)26(28)30-24(4-2)21-16-11-10-12-17-21/h10-14,16-19,24H,3-9,15,20H2,1-2H3
InChIKey PIRUYTXMLZAWFL-UHFFFAOYSA-N
Molecular Weight 410.554 g/mol
SMILES C(OC(CC)C1=CC=CC=C1)(=O)C1=C(C=CC=C1)C(OCCCCCCCCC)=O