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

*Links on SpectraBase are not permalinks.

Phthalic acid, 4-chloro-2-methoxybenzyl dodecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 4-chloro-2-methoxybenzyl dodecyl ester
SpectraBase Compound ID FzPAWtXJSrE
InChI InChI=1S/C28H37ClO5/c1-3-4-5-6-7-8-9-10-11-14-19-33-27(30)24-15-12-13-16-25(24)28(31)34-21-22-17-18-23(29)20-26(22)32-2/h12-13,15-18,20H,3-11,14,19,21H2,1-2H3
InChIKey WXROEQMAFPMRPJ-UHFFFAOYSA-N
Mol Weight 489.1 g/mol
Molecular Formula C28H37ClO5
Exact Mass 488.232952 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 346nTGJv2Kp
Name Phthalic acid, 4-chloro-2-methoxybenzyl dodecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 488.232951986 u
Formula C28H37ClO5
InChI InChI=1S/C28H37ClO5/c1-3-4-5-6-7-8-9-10-11-14-19-33-27(30)24-15-12-13-16-25(24)28(31)34-21-22-17-18-23(29)20-26(22)32-2/h12-13,15-18,20H,3-11,14,19,21H2,1-2H3
InChIKey WXROEQMAFPMRPJ-UHFFFAOYSA-N
Molecular Weight 489.052 g/mol
SMILES C1=CC(=C(C=C1)C(=O)OCC=1C(OC)=CC(=CC1)Cl)C(=O)OCCCCCCCCCCCC