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Succinic acid, ethyl 2-octyl ester
SpectraBase Compound ID rx6L7Qg32y
InChI InChI=1S/C14H26O4/c1-4-6-7-8-9-12(3)18-14(16)11-10-13(15)17-5-2/h12H,4-11H2,1-3H3
InChIKey PZKIHFJEWQLWEY-UHFFFAOYSA-N
Mol Weight 258.36 g/mol
Molecular Formula C14H26O4
Exact Mass 258.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3U7qWwyaAxK
Name Succinic acid, ethyl 2-octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 258.183109313 u
Formula C14H26O4
InChI InChI=1S/C14H26O4/c1-4-6-7-8-9-12(3)18-14(16)11-10-13(15)17-5-2/h12H,4-11H2,1-3H3
InChIKey PZKIHFJEWQLWEY-UHFFFAOYSA-N
Molecular Weight 258.358 g/mol
SMILES C(CC(OC(C)CCCCCC)=O)C(OCC)=O