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Phthalic acid, 1-tert-butoxyprop-2-yl undecyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, 1-tert-butoxyprop-2-yl undecyl ester
SpectraBase Compound ID 1fh0z8wl1xh
InChI InChI=1S/C26H42O5/c1-6-7-8-9-10-11-12-13-16-19-29-24(27)22-17-14-15-18-23(22)25(28)31-21(2)20-30-26(3,4)5/h14-15,17-18,21H,6-13,16,19-20H2,1-5H3
InChIKey IIRSNTQDRHAKDE-UHFFFAOYSA-N
Mol Weight 434.6 g/mol
Molecular Formula C26H42O5
Exact Mass 434.303224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7e1By6a48Cl
Name Phthalic acid, 1-tert-butoxyprop-2-yl undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 434.303224447 u
Formula C26H42O5
InChI InChI=1S/C26H42O5/c1-6-7-8-9-10-11-12-13-16-19-29-24(27)22-17-14-15-18-23(22)25(28)31-21(2)20-30-26(3,4)5/h14-15,17-18,21H,6-13,16,19-20H2,1-5H3
InChIKey IIRSNTQDRHAKDE-UHFFFAOYSA-N
Molecular Weight 434.617 g/mol
SMILES C1=CC=CC(=C1C(OCCCCCCCCCCC)=O)C(OC(C)COC(C)(C)C)=O