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Succinic acid, 2,2-dichloroethyl tetradec-3-en-1-yl ester
SpectraBase Compound ID JaOQduAdL7c
InChI InChI=1S/C20H34Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25-19(23)14-15-20(24)26-17-18(21)22/h11-12,18H,2-10,13-17H2,1H3/b12-11+
InChIKey XSAPMBSWKUPRNS-VAWYXSNFSA-N
Mol Weight 409.4 g/mol
Molecular Formula C20H34Cl2O4
Exact Mass 408.183415 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60DxT44RXa8
Name Succinic acid, 2,2-dichloroethyl tetradec-3-en-1-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 408.183414971 u
Formula C20H34Cl2O4
InChI InChI=1S/C20H34Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-25-19(23)14-15-20(24)26-17-18(21)22/h11-12,18H,2-10,13-17H2,1H3/b12-11+
InChIKey XSAPMBSWKUPRNS-VAWYXSNFSA-N
Molecular Weight 409.394 g/mol
SMILES C(CC(OCC(Cl)Cl)=O)C(OCC\C=C\CCCCCCCCCC)=O