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Methyl 11,12-butylborondioxy-8-(trimethylsiloxy)eicosanote

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

Methyl 11,12-butylborondioxy-8-(trimethylsiloxy)eicosanote
SpectraBase Compound ID Du6vrEmA35N
InChI InChI=1S/C28H57BO5Si/c1-7-9-11-12-13-17-20-26-27(33-29(32-26)24-10-8-2)23-22-25(34-35(4,5)6)19-16-14-15-18-21-28(30)31-3/h25-27H,7-24H2,1-6H3
InChIKey SQHSHOARMAPOAW-UHFFFAOYSA-N
Mol Weight 512.7 g/mol
Molecular Formula C28H57BO5Si
Exact Mass 512.406832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 94bFSw7G5HH
Name Methyl 11,12-butylborondioxy-8-(trimethylsiloxy)eicosanote
Comments Computed using HOSE algorithm
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Exact Mass 512.406831635 u
Formula C28H57BO5Si
InChI InChI=1S/C28H57BO5Si/c1-7-9-11-12-13-17-20-26-27(33-29(32-26)24-10-8-2)23-22-25(34-35(4,5)6)19-16-14-15-18-21-28(30)31-3/h25-27H,7-24H2,1-6H3
InChIKey SQHSHOARMAPOAW-UHFFFAOYSA-N
Molecular Weight 512.654 g/mol
SMILES C1(OB(OC1CCCCCCCC)CCCC)CCC(O[Si](C)(C)C)CCCCCCC(=O)OC