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12-[Tert-butyl(dimethyl)silyl]oxyarachidic acid methyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

12-[Tert-butyl(dimethyl)silyl]oxyarachidic acid methyl ester
SpectraBase Compound ID KyuxIobUVU8
InChI InChI=1S/C27H56O3Si/c1-8-9-10-11-16-19-22-25(30-31(6,7)27(2,3)4)23-20-17-14-12-13-15-18-21-24-26(28)29-5/h25H,8-24H2,1-7H3
InChIKey MSOZAJAVDIMHPP-UHFFFAOYSA-N
Mol Weight 456.8 g/mol
Molecular Formula C27H56O3Si
Exact Mass 456.399872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Hx4krptDcw
Name 12-[Tert-butyl(dimethyl)silyl]oxyarachidic acid methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 456.399872195 u
Formula C27H56O3Si
InChI InChI=1S/C27H56O3Si/c1-8-9-10-11-16-19-22-25(30-31(6,7)27(2,3)4)23-20-17-14-12-13-15-18-21-24-26(28)29-5/h25H,8-24H2,1-7H3
InChIKey MSOZAJAVDIMHPP-UHFFFAOYSA-N
Molecular Weight 456.827 g/mol
SMILES C([Si](OC(CCCCCCCC)CCCCCCCCCCC(=O)OC)(C)C)(C)(C)C