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Glutaric acid, 2,4-dichlorobenzyl pentadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,4-dichlorobenzyl pentadecyl ester
SpectraBase Compound ID 8ai5lL1AK1y
InChI InChI=1S/C27H42Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-32-26(30)16-15-17-27(31)33-22-23-18-19-24(28)21-25(23)29/h18-19,21H,2-17,20,22H2,1H3
InChIKey KWNGEVZCLPRPSW-UHFFFAOYSA-N
Mol Weight 501.5 g/mol
Molecular Formula C27H42Cl2O4
Exact Mass 500.246015 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CGVN91me5Nf
Name Glutaric acid, 2,4-dichlorobenzyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 500.246015228 u
Formula C27H42Cl2O4
InChI InChI=1S/C27H42Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-32-26(30)16-15-17-27(31)33-22-23-18-19-24(28)21-25(23)29/h18-19,21H,2-17,20,22H2,1H3
InChIKey KWNGEVZCLPRPSW-UHFFFAOYSA-N
Molecular Weight 501.535 g/mol
SMILES C(OCC1=C(C=C(C=C1)Cl)Cl)(=O)CCCC(OCCCCCCCCCCCCCCC)=O