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Succinic acid, 2-ethylhexyl 4-heptyl ester
SpectraBase Compound ID BfazHpKv8Lu
InChI InChI=1S/C19H36O4/c1-5-9-12-16(8-4)15-22-18(20)13-14-19(21)23-17(10-6-2)11-7-3/h16-17H,5-15H2,1-4H3
InChIKey AVZZHRAFKSNAOA-UHFFFAOYSA-N
Mol Weight 328.5 g/mol
Molecular Formula C19H36O4
Exact Mass 328.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BE7xgj3dxDn
Name Succinic acid, 2-ethylhexyl 4-heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 328.261359635 u
Formula C19H36O4
InChI InChI=1S/C19H36O4/c1-5-9-12-16(8-4)15-22-18(20)13-14-19(21)23-17(10-6-2)11-7-3/h16-17H,5-15H2,1-4H3
InChIKey AVZZHRAFKSNAOA-UHFFFAOYSA-N
Molecular Weight 328.493 g/mol
SMILES C(CC(OCC(CC)CCCC)=O)C(OC(CCC)CCC)=O