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Succinic acid, butyl dodecyl ester
SpectraBase Compound ID HZjEgVyJmWJ
InChI InChI=1S/C20H38O4/c1-3-5-7-8-9-10-11-12-13-14-18-24-20(22)16-15-19(21)23-17-6-4-2/h3-18H2,1-2H3
InChIKey QCEBSRFUGFWYPT-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C20H38O4
Exact Mass 342.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABvjUByd1nI
Name Succinic acid, butyl dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 342.277009700 u
Formula C20H38O4
InChI InChI=1S/C20H38O4/c1-3-5-7-8-9-10-11-12-13-14-18-24-20(22)16-15-19(21)23-17-6-4-2/h3-18H2,1-2H3
InChIKey QCEBSRFUGFWYPT-UHFFFAOYSA-N
Molecular Weight 342.520 g/mol
SMILES CCCCCCCCCCCCOC(CCC(OCCCC)=O)=O