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Glutaric acid, pentadecyl 1-phenylpropyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, pentadecyl 1-phenylpropyl ester
SpectraBase Compound ID F89JfCtjTcZ
InChI InChI=1S/C29H48O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-25-32-28(30)23-20-24-29(31)33-27(4-2)26-21-17-16-18-22-26/h16-18,21-22,27H,3-15,19-20,23-25H2,1-2H3
InChIKey WEFRIJVVRIMXKW-UHFFFAOYSA-N
Mol Weight 460.7 g/mol
Molecular Formula C29H48O4
Exact Mass 460.35526 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KNBVaIBfXdD
Name Glutaric acid, pentadecyl 1-phenylpropyl ester
Comments Computed using HOSE algorithm
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Exact Mass 460.355260022 u
Formula C29H48O4
InChI InChI=1S/C29H48O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-25-32-28(30)23-20-24-29(31)33-27(4-2)26-21-17-16-18-22-26/h16-18,21-22,27H,3-15,19-20,23-25H2,1-2H3
InChIKey WEFRIJVVRIMXKW-UHFFFAOYSA-N
Molecular Weight 460.699 g/mol
SMILES C(C(OC(=O)CCCC(OCCCCCCCCCCCCCCC)=O)C1=CC=CC=C1)C