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Succinic acid, isohexyl 4-octyl ester
SpectraBase Compound ID I7HDkNAAQ9D
InChI InChI=1S/C18H34O4/c1-5-7-11-16(9-6-2)22-18(20)13-12-17(19)21-14-8-10-15(3)4/h15-16H,5-14H2,1-4H3
InChIKey AZKGDDQWTACSEH-UHFFFAOYSA-N
Mol Weight 314.5 g/mol
Molecular Formula C18H34O4
Exact Mass 314.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5tPBVvzu5zZ
Name Succinic acid, isohexyl 4-octyl ester
Comments Computed using HOSE algorithm
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Exact Mass 314.245709571 u
Formula C18H34O4
InChI InChI=1S/C18H34O4/c1-5-7-11-16(9-6-2)22-18(20)13-12-17(19)21-14-8-10-15(3)4/h15-16H,5-14H2,1-4H3
InChIKey AZKGDDQWTACSEH-UHFFFAOYSA-N
SMILES C(CC(OC(=O)CCC(OCCCC(C)C)=O)CCCC)C