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Phthalic acid, 2,4-dichlorobenzyl pentadecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 2,4-dichlorobenzyl pentadecyl ester
SpectraBase Compound ID 1az9eptshea
InChI InChI=1S/C30H40Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-35-29(33)26-17-14-15-18-27(26)30(34)36-23-24-19-20-25(31)22-28(24)32/h14-15,17-20,22H,2-13,16,21,23H2,1H3
InChIKey OQJCEWMAXFVYIG-UHFFFAOYSA-N
Mol Weight 535.6 g/mol
Molecular Formula C30H40Cl2O4
Exact Mass 534.230365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E6s18sYOm7Z
Name Phthalic acid, 2,4-dichlorobenzyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 534.230365164 u
Formula C30H40Cl2O4
InChI InChI=1S/C30H40Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-35-29(33)26-17-14-15-18-27(26)30(34)36-23-24-19-20-25(31)22-28(24)32/h14-15,17-20,22H,2-13,16,21,23H2,1H3
InChIKey OQJCEWMAXFVYIG-UHFFFAOYSA-N
Molecular Weight 535.552 g/mol
SMILES C1=CC(=C(C=C1)C(=O)OCC1=C(C=C(C=C1)Cl)Cl)C(=O)OCCCCCCCCCCCCCCC