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Glutaric acid, 3-phenylpropyl tetradecyl ester
SpectraBase Compound ID GLyAVFhc1v
InChI InChI=1S/C28H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-16-24-31-27(29)22-17-23-28(30)32-25-18-21-26-19-14-13-15-20-26/h13-15,19-20H,2-12,16-18,21-25H2,1H3
InChIKey GEBQGWWWCNEPEY-UHFFFAOYSA-N
Mol Weight 446.7 g/mol
Molecular Formula C28H46O4
Exact Mass 446.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID nlj1kcuRlK
Name Glutaric acid, 3-phenylpropyl tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 446.339609957 u
Formula C28H46O4
InChI InChI=1S/C28H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-16-24-31-27(29)22-17-23-28(30)32-25-18-21-26-19-14-13-15-20-26/h13-15,19-20H,2-12,16-18,21-25H2,1H3
InChIKey GEBQGWWWCNEPEY-UHFFFAOYSA-N
Molecular Weight 446.672 g/mol
SMILES CCCCCCCCCCCCCCOC(CCCC(OCCCC1=CC=CC=C1)=O)=O