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

*Links on SpectraBase are not permalinks.

Phthalic acid, 2-fluorobenzyl undecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2-fluorobenzyl undecyl ester
SpectraBase Compound ID 9h4ADbQvi2O
InChI InChI=1S/C26H33FO4/c1-2-3-4-5-6-7-8-9-14-19-30-25(28)22-16-11-12-17-23(22)26(29)31-20-21-15-10-13-18-24(21)27/h10-13,15-18H,2-9,14,19-20H2,1H3
InChIKey QSHYWPKQMVDYSN-UHFFFAOYSA-N
Mol Weight 428.5 g/mol
Molecular Formula C26H33FO4
Exact Mass 428.236288 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 BCcQzcwaL3E
Name Phthalic acid, 2-fluorobenzyl undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.236287702 u
Formula C26H33FO4
InChI InChI=1S/C26H33FO4/c1-2-3-4-5-6-7-8-9-14-19-30-25(28)22-16-11-12-17-23(22)26(29)31-20-21-15-10-13-18-24(21)27/h10-13,15-18H,2-9,14,19-20H2,1H3
InChIKey QSHYWPKQMVDYSN-UHFFFAOYSA-N
Molecular Weight 428.544 g/mol
SMILES C1=CC=CC(=C1C(OCCCCCCCCCCC)=O)C(OCC1=CC=CC=C1F)=O