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Glutaric acid, 2-methylphenyl pentadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-methylphenyl pentadecyl ester
SpectraBase Compound ID 2Diccw3VbIR
InChI InChI=1S/C27H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-23-30-26(28)21-18-22-27(29)31-25-20-16-15-19-24(25)2/h15-16,19-20H,3-14,17-18,21-23H2,1-2H3
InChIKey NKYPCEKCZNWCDC-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C27H44O4
Exact Mass 432.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LNUnHGA4a4X
Name Glutaric acid, 2-methylphenyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 432.323959893 u
Formula C27H44O4
InChI InChI=1S/C27H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-23-30-26(28)21-18-22-27(29)31-25-20-16-15-19-24(25)2/h15-16,19-20H,3-14,17-18,21-23H2,1-2H3
InChIKey NKYPCEKCZNWCDC-UHFFFAOYSA-N
Molecular Weight 432.645 g/mol
SMILES CCCCCCCCCCCCCCCOC(CCCC(OC1=C(C=CC=C1)C)=O)=O