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Glutaric acid, hexadecyl phenethyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, hexadecyl phenethyl ester
SpectraBase Compound ID 9r4hUj633FZ
InChI InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-25-32-28(30)22-19-23-29(31)33-26-24-27-20-16-15-17-21-27/h15-17,20-21H,2-14,18-19,22-26H2,1H3
InChIKey CLKWOSVEGMJFIY-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 3LfLSZrLXTa
Name Glutaric acid, hexadecyl phenethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 460.355260022 u
Formula C29H48O4
InChI InChI=1S/C29H48O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-25-32-28(30)22-19-23-29(31)33-26-24-27-20-16-15-17-21-27/h15-17,20-21H,2-14,18-19,22-26H2,1H3
InChIKey CLKWOSVEGMJFIY-UHFFFAOYSA-N
Molecular Weight 460.699 g/mol
SMILES CCCCCCCCCCCCCCCCOC(CCCC(OCCC1=CC=CC=C1)=O)=O