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Glutaric acid, 2-naphthyl tridecyl ester
SpectraBase Compound ID EzTiYlF0MAw
InChI InChI=1S/C28H40O4/c1-2-3-4-5-6-7-8-9-10-11-14-22-31-27(29)18-15-19-28(30)32-26-21-20-24-16-12-13-17-25(24)23-26/h12-13,16-17,20-21,23H,2-11,14-15,18-19,22H2,1H3
InChIKey YZYVDIBCPKHHTM-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C28H40O4
Exact Mass 440.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5UuFzVL3LOz
Name Glutaric acid, 2-naphthyl tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 440.292659764 u
Formula C28H40O4
InChI InChI=1S/C28H40O4/c1-2-3-4-5-6-7-8-9-10-11-14-22-31-27(29)18-15-19-28(30)32-26-21-20-24-16-12-13-17-25(24)23-26/h12-13,16-17,20-21,23H,2-11,14-15,18-19,22H2,1H3
InChIKey YZYVDIBCPKHHTM-UHFFFAOYSA-N
Molecular Weight 440.624 g/mol
SMILES CCCCCCCCCCCCCOC(CCCC(OC1=CC=C2C(=C1)C=CC=C2)=O)=O