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Glutaric acid, 2,3-dichlorophenyl 10-chlorodecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,3-dichlorophenyl 10-chlorodecyl ester
SpectraBase Compound ID 4NviRoejVcl
InChI InChI=1S/C21H29Cl3O4/c22-15-7-5-3-1-2-4-6-8-16-27-19(25)13-10-14-20(26)28-18-12-9-11-17(23)21(18)24/h9,11-12H,1-8,10,13-16H2
InChIKey MGGDMXNYLPMZOC-UHFFFAOYSA-N
Mol Weight 451.82 g/mol
Molecular Formula C21H29Cl3O4
Exact Mass 450.113143 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zlYwxD0gxP
Name Glutaric acid, 2,3-dichlorophenyl 10-chlorodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 450.113142510 u
Formula C21H29Cl3O4
InChI InChI=1S/C21H29Cl3O4/c22-15-7-5-3-1-2-4-6-8-16-27-19(25)13-10-14-20(26)28-18-12-9-11-17(23)21(18)24/h9,11-12H,1-8,10,13-16H2
InChIKey MGGDMXNYLPMZOC-UHFFFAOYSA-N
Molecular Weight 451.818 g/mol
SMILES C(CCC(OCCCCCCCCCCCl)=O)C(OC1=CC=CC(=C1Cl)Cl)=O