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Glutaric acid, 2,6-dimethoxyphenyl tridecyl ester
SpectraBase Compound ID W53lg9gvOs
InChI InChI=1S/C26H42O6/c1-4-5-6-7-8-9-10-11-12-13-14-21-31-24(27)19-16-20-25(28)32-26-22(29-2)17-15-18-23(26)30-3/h15,17-18H,4-14,16,19-21H2,1-3H3
InChIKey RPTVMYJVVIDDQK-UHFFFAOYSA-N
Mol Weight 450.6 g/mol
Molecular Formula C26H42O6
Exact Mass 450.298139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HR5H69R5wm
Name Glutaric acid, 2,6-dimethoxyphenyl tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 450.298139066 u
Formula C26H42O6
InChI InChI=1S/C26H42O6/c1-4-5-6-7-8-9-10-11-12-13-14-21-31-24(27)19-16-20-25(28)32-26-22(29-2)17-15-18-23(26)30-3/h15,17-18H,4-14,16,19-21H2,1-3H3
InChIKey RPTVMYJVVIDDQK-UHFFFAOYSA-N
Molecular Weight 450.616 g/mol
SMILES CCCCCCCCCCCCCOC(CCCC(OC1=C(C=CC=C1OC)OC)=O)=O