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Glutaric acid, dec-2-yl 5-methyl-2-methoxybenzyl ester
SpectraBase Compound ID 3TqE8teCuLD
InChI InChI=1S/C23H36O5/c1-5-6-7-8-9-10-12-19(3)27-22(24)13-11-14-23(25)28-21-17-18(2)15-16-20(21)26-4/h15-17,19H,5-14H2,1-4H3
InChIKey MRGXYTCQVIUYAJ-UHFFFAOYSA-N
Mol Weight 392.5 g/mol
Molecular Formula C23H36O5
Exact Mass 392.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HX40esLiBQi
Name Glutaric acid, dec-2-yl 5-methyl-2-methoxybenzyl ester
Comments Computed using HOSE algorithm
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Exact Mass 392.256274254 u
Formula C23H36O5
InChI InChI=1S/C23H36O5/c1-5-6-7-8-9-10-12-19(3)27-22(24)13-11-14-23(25)28-21-17-18(2)15-16-20(21)26-4/h15-17,19H,5-14H2,1-4H3
InChIKey MRGXYTCQVIUYAJ-UHFFFAOYSA-N
Molecular Weight 392.536 g/mol
SMILES C(CCC(OC(CCCCCCCC)C)=O)C(OC1=CC(C)=CC=C1OC)=O