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

*Links on SpectraBase are not permalinks.

Glutaric acid, 2-(3-chlorophenyl)ethyl hexadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-(3-chlorophenyl)ethyl hexadecyl ester
SpectraBase Compound ID HICczSEtNX6
InChI InChI=1S/C29H47ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-33-28(31)20-17-21-29(32)34-24-22-26-18-16-19-27(30)25-26/h16,18-19,25H,2-15,17,20-24H2,1H3
InChIKey RAXIRJGCCHUKBY-UHFFFAOYSA-N
Mol Weight 495.1 g/mol
Molecular Formula C29H47ClO4
Exact Mass 494.316288 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 63RULxWasda
Name Glutaric acid, 2-(3-chlorophenyl)ethyl hexadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 494.316287689 u
Formula C29H47ClO4
InChI InChI=1S/C29H47ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23-33-28(31)20-17-21-29(32)34-24-22-26-18-16-19-27(30)25-26/h16,18-19,25H,2-15,17,20-24H2,1H3
InChIKey RAXIRJGCCHUKBY-UHFFFAOYSA-N
Molecular Weight 495.144 g/mol
SMILES C(OCCC1=CC(=CC=C1)Cl)(=O)CCCC(OCCCCCCCCCCCCCCCC)=O