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Glutaric acid, 3-methylphenyl pentadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 3-methylphenyl pentadecyl ester
SpectraBase Compound ID LdluPCB6e6D
InChI InChI=1S/C27H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-30-26(28)20-17-21-27(29)31-25-19-16-18-24(2)23-25/h16,18-19,23H,3-15,17,20-22H2,1-2H3
InChIKey IOGSIASXMRTLDF-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 5tc7HzSYzvV
Name Glutaric acid, 3-methylphenyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 432.323959893 u
Formula C27H44O4
InChI InChI=1S/C27H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-30-26(28)20-17-21-27(29)31-25-19-16-18-24(2)23-25/h16,18-19,23H,3-15,17,20-22H2,1-2H3
InChIKey IOGSIASXMRTLDF-UHFFFAOYSA-N
Molecular Weight 432.645 g/mol
SMILES C(OC1=CC=CC(=C1)C)(=O)CCCC(OCCCCCCCCCCCCCCC)=O