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Succinic acid, 3,5-dichlorophenyl hexadecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 3,5-dichlorophenyl hexadecyl ester
SpectraBase Compound ID DudBxTPQX69
InChI InChI=1S/C26H40Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-31-25(29)16-17-26(30)32-24-20-22(27)19-23(28)21-24/h19-21H,2-18H2,1H3
InChIKey ZLZQSUVVBFWQQT-UHFFFAOYSA-N
Mol Weight 487.5 g/mol
Molecular Formula C26H40Cl2O4
Exact Mass 486.230365 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HXfMgzm8zKo
Name Succinic acid, 3,5-dichlorophenyl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 486.230365164 u
Formula C26H40Cl2O4
InChI InChI=1S/C26H40Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-31-25(29)16-17-26(30)32-24-20-22(27)19-23(28)21-24/h19-21H,2-18H2,1H3
InChIKey ZLZQSUVVBFWQQT-UHFFFAOYSA-N
Molecular Weight 487.508 g/mol
SMILES C(C(OC1=CC(=CC(=C1)Cl)Cl)=O)CC(OCCCCCCCCCCCCCCCC)=O