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Glutaric acid, dec-2-yl 2,6-dimethoxyphenyl ester
SpectraBase Compound ID 5sgVVg2Ywdq
InChI InChI=1S/C23H36O6/c1-5-6-7-8-9-10-13-18(2)28-21(24)16-12-17-22(25)29-23-19(26-3)14-11-15-20(23)27-4/h11,14-15,18H,5-10,12-13,16-17H2,1-4H3
InChIKey QYAPQJYBUCHKQI-UHFFFAOYSA-N
Mol Weight 408.5 g/mol
Molecular Formula C23H36O6
Exact Mass 408.251189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KJQirV1NGux
Name Glutaric acid, dec-2-yl 2,6-dimethoxyphenyl ester
Comments Computed using HOSE algorithm
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Exact Mass 408.251188873 u
Formula C23H36O6
InChI InChI=1S/C23H36O6/c1-5-6-7-8-9-10-13-18(2)28-21(24)16-12-17-22(25)29-23-19(26-3)14-11-15-20(23)27-4/h11,14-15,18H,5-10,12-13,16-17H2,1-4H3
InChIKey QYAPQJYBUCHKQI-UHFFFAOYSA-N
Molecular Weight 408.535 g/mol
SMILES C(CCC(OC(C)CCCCCCCC)=O)C(OC1=C(C=CC=C1OC)OC)=O