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Glutaric acid, heptadecyl phenethyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, heptadecyl phenethyl ester
SpectraBase Compound ID IfE3g8F4BFs
InChI InChI=1S/C30H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-26-33-29(31)23-20-24-30(32)34-27-25-28-21-17-16-18-22-28/h16-18,21-22H,2-15,19-20,23-27H2,1H3
InChIKey NUKQMRACJWVUMJ-UHFFFAOYSA-N
Mol Weight 474.7 g/mol
Molecular Formula C30H50O4
Exact Mass 474.37091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 32YE46kgiza
Name Glutaric acid, heptadecyl phenethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 474.370910086 u
Formula C30H50O4
InChI InChI=1S/C30H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-26-33-29(31)23-20-24-30(32)34-27-25-28-21-17-16-18-22-28/h16-18,21-22H,2-15,19-20,23-27H2,1H3
InChIKey NUKQMRACJWVUMJ-UHFFFAOYSA-N
Molecular Weight 474.726 g/mol
SMILES CCCCCCCCCCCCCCCCCOC(CCCC(OCCC1=CC=CC=C1)=O)=O