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1,3,2(-tri-o-Trimethylsilyl-N-(2(-hydroxytetracosanoyl)sphingosine

View entire compound with spectra: 1 NMR

1,3,2(-tri-o-Trimethylsilyl-N-(2(-hydroxytetracosanoyl)sphingosine
SpectraBase Compound ID H8d89ilvYfn
InChI InChI=1S/C51H107NO4Si3/c1-12-14-16-18-20-22-24-26-27-28-29-30-31-32-33-35-36-38-40-42-44-46-48(54-57(3,4)5)50(53)52-51(56-59(9,10)11)49(55-58(6,7)8)47-45-43-41-39-37-34-25-23-21-19-17-15-13-2/h45,47-49,51H,12-44,46H2,1-11H3,(H,52,53)/b47-45+
InChIKey JRZZPXMFCGHATA-LIIAXHHNSA-N
Mol Weight 882.7 g/mol
Molecular Formula C51H107NO4Si3
Exact Mass 881.750791 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AbT3pp3Yua7
Name 1,3,2(-tri-o-Trimethylsilyl-N-(2(-hydroxytetracosanoyl)sphingosine
Comments Computed using HOSE algorithm
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Exact Mass 881.750790530 u
Formula C51H107NO4Si3
InChI InChI=1S/C51H107NO4Si3/c1-12-14-16-18-20-22-24-26-27-28-29-30-31-32-33-35-36-38-40-42-44-46-48(54-57(3,4)5)50(53)52-51(56-59(9,10)11)49(55-58(6,7)8)47-45-43-41-39-37-34-25-23-21-19-17-15-13-2/h45,47-49,51H,12-44,46H2,1-11H3,(H,52,53)/b47-45+
InChIKey JRZZPXMFCGHATA-LIIAXHHNSA-N
Molecular Weight 882.675 g/mol
SMILES C(NC(C(CCCCCCCCCCCCCCCCCCCCCCC)O[Si](C)(C)C)=O)(O[Si](C)(C)C)C(\C=C\CCCCCCCCCCCCC)O[Si](C)(C)C