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Glutaric acid, 1-(tert-butoxy)prop-2-yl hexadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 1-(tert-butoxy)prop-2-yl hexadecyl ester
SpectraBase Compound ID 2cZc47Ff8Ns
InChI InChI=1S/C28H54O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-31-26(29)21-20-22-27(30)33-25(2)24-32-28(3,4)5/h25H,6-24H2,1-5H3
InChIKey OBVFNBCAVCAEPP-UHFFFAOYSA-N
Mol Weight 470.7 g/mol
Molecular Formula C28H54O5
Exact Mass 470.397125 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FnDX6CdFHIR
Name Glutaric acid, 1-(tert-butoxy)prop-2-yl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 470.397124834 u
Formula C28H54O5
InChI InChI=1S/C28H54O5/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-31-26(29)21-20-22-27(30)33-25(2)24-32-28(3,4)5/h25H,6-24H2,1-5H3
InChIKey OBVFNBCAVCAEPP-UHFFFAOYSA-N
Molecular Weight 470.735 g/mol
SMILES C(CCCC(OC(C)COC(C)(C)C)=O)(OCCCCCCCCCCCCCCCC)=O