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Succinic acid, 2-cyclohexylethyl hexyl ester
SpectraBase Compound ID 7e5eUaw3bd8
InChI InChI=1S/C18H32O4/c1-2-3-4-8-14-21-17(19)11-12-18(20)22-15-13-16-9-6-5-7-10-16/h16H,2-15H2,1H3
InChIKey BJZVHJGCVFLBSZ-UHFFFAOYSA-N
Mol Weight 312.5 g/mol
Molecular Formula C18H32O4
Exact Mass 312.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FysrLR5A1mv
Name Succinic acid, 2-cyclohexylethyl hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 312.230059506 u
Formula C18H32O4
InChI InChI=1S/C18H32O4/c1-2-3-4-8-14-21-17(19)11-12-18(20)22-15-13-16-9-6-5-7-10-16/h16H,2-15H2,1H3
InChIKey BJZVHJGCVFLBSZ-UHFFFAOYSA-N
Molecular Weight 312.450 g/mol
SMILES C(OCCC1CCCCC1)(CCC(OCCCCCC)=O)=O