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Succinic acid, 2-ethylhexyl 2-methoxy-5-methylphenyl ester
SpectraBase Compound ID 4L4S4ItUi0P
InChI InChI=1S/C20H30O5/c1-5-7-8-16(6-2)14-24-19(21)11-12-20(22)25-18-13-15(3)9-10-17(18)23-4/h9-10,13,16H,5-8,11-12,14H2,1-4H3
InChIKey SIRFDSCIJLBZJG-UHFFFAOYSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwFijCXArRp
Name Succinic acid, 2-ethylhexyl 2-methoxy-5-methylphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 350.209324061 u
Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-5-7-8-16(6-2)14-24-19(21)11-12-20(22)25-18-13-15(3)9-10-17(18)23-4/h9-10,13,16H,5-8,11-12,14H2,1-4H3
InChIKey SIRFDSCIJLBZJG-UHFFFAOYSA-N
Molecular Weight 350.455 g/mol
SMILES C(CC(OCC(CC)CCCC)=O)C(OC1=C(C=CC(=C1)C)OC)=O