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Glutaric acid, 4-chloro-3-methylphenyl pentadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 4-chloro-3-methylphenyl pentadecyl ester
SpectraBase Compound ID I1QnOXVSzTd
InChI InChI=1S/C27H43ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-21-31-26(29)17-16-18-27(30)32-24-19-20-25(28)23(2)22-24/h19-20,22H,3-18,21H2,1-2H3
InChIKey LJYSIVSUIMQSBQ-UHFFFAOYSA-N
Mol Weight 467.1 g/mol
Molecular Formula C27H43ClO4
Exact Mass 466.284988 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Y0wQ2nEkpy
Name Glutaric acid, 4-chloro-3-methylphenyl pentadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.284987561 u
Formula C27H43ClO4
InChI InChI=1S/C27H43ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-21-31-26(29)17-16-18-27(30)32-24-19-20-25(28)23(2)22-24/h19-20,22H,3-18,21H2,1-2H3
InChIKey LJYSIVSUIMQSBQ-UHFFFAOYSA-N
Molecular Weight 467.090 g/mol
SMILES CCCCCCCCCCCCCCCOC(CCCC(OC1=CC=C(C(=C1)C)Cl)=O)=O