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Tert-butyldimethylsilyl dodecyl phthalate

View entire compound with spectra: 1 NMR

Tert-butyldimethylsilyl dodecyl phthalate
SpectraBase Compound ID 69kS6zXObBh
InChI InChI=1S/C26H44O4Si/c1-7-8-9-10-11-12-13-14-15-18-21-29-24(27)22-19-16-17-20-23(22)25(28)30-31(5,6)26(2,3)4/h16-17,19-20H,7-15,18,21H2,1-6H3
InChIKey XXAGZSYBKRPALT-UHFFFAOYSA-N
Mol Weight 448.7 g/mol
Molecular Formula C26H44O4Si
Exact Mass 448.300886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L6wHDPQCqqy
Name Tert-butyldimethylsilyl dodecyl phthalate
Comments Computed using HOSE algorithm
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Exact Mass 448.300886428 u
Formula C26H44O4Si
InChI InChI=1S/C26H44O4Si/c1-7-8-9-10-11-12-13-14-15-18-21-29-24(27)22-19-16-17-20-23(22)25(28)30-31(5,6)26(2,3)4/h16-17,19-20H,7-15,18,21H2,1-6H3
InChIKey XXAGZSYBKRPALT-UHFFFAOYSA-N
Molecular Weight 448.719 g/mol
SMILES C1=CC=CC(=C1C(=O)OCCCCCCCCCCCC)C(=O)O[Si](C(C)(C)C)(C)C