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Succinic acid, butyl heptyl ester
SpectraBase Compound ID 5RE9Br8OH47
InChI InChI=1S/C15H28O4/c1-3-5-7-8-9-13-19-15(17)11-10-14(16)18-12-6-4-2/h3-13H2,1-2H3
InChIKey PMUGTBMIZGQHPF-UHFFFAOYSA-N
Mol Weight 272.38 g/mol
Molecular Formula C15H28O4
Exact Mass 272.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CVtmiDSPhvn
Name Succinic acid, butyl heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 272.198759378 u
Formula C15H28O4
InChI InChI=1S/C15H28O4/c1-3-5-7-8-9-13-19-15(17)11-10-14(16)18-12-6-4-2/h3-13H2,1-2H3
InChIKey PMUGTBMIZGQHPF-UHFFFAOYSA-N
SMILES C(OCCCC)(=O)CCC(OCCCCCCC)=O