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Glutaric acid, 4-chlorobenzyl tridecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 4-chlorobenzyl tridecyl ester
SpectraBase Compound ID 4T9KoFhk9LY
InChI InChI=1S/C25H39ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-20-29-24(27)14-13-15-25(28)30-21-22-16-18-23(26)19-17-22/h16-19H,2-15,20-21H2,1H3
InChIKey CMPRZHQHRFYETR-UHFFFAOYSA-N
Mol Weight 439.0 g/mol
Molecular Formula C25H39ClO4
Exact Mass 438.253687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KQsLZvb3ziN
Name Glutaric acid, 4-chlorobenzyl tridecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.253687432 u
Formula C25H39ClO4
InChI InChI=1S/C25H39ClO4/c1-2-3-4-5-6-7-8-9-10-11-12-20-29-24(27)14-13-15-25(28)30-21-22-16-18-23(26)19-17-22/h16-19H,2-15,20-21H2,1H3
InChIKey CMPRZHQHRFYETR-UHFFFAOYSA-N
Molecular Weight 439.036 g/mol
SMILES CCCCCCCCCCCCCOC(CCCC(OCC1=CC=C(C=C1)Cl)=O)=O