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C14 Dihydroceramide, 3tms derivative

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C14 Dihydroceramide, 3tms derivative
SpectraBase Compound ID 6q4OZ7hSO91
InChI InChI=1S/C41H89NO3Si3/c1-12-14-16-18-20-22-24-25-27-28-30-32-34-36-40(45-48(9,10)11)39(38-44-47(6,7)8)42(46(3,4)5)41(43)37-35-33-31-29-26-23-21-19-17-15-13-2/h39-40H,12-38H2,1-11H3/t39-,40+/m0/s1
InChIKey LTEUWCKJSSWREY-IOLBBIBUSA-N
Mol Weight 728.4 g/mol
Molecular Formula C41H89NO3Si3
Exact Mass 727.615025 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7OEBJvzuadj
Name C14 Dihydroceramide, 3tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 727.615025332 u
Formula C41H89NO3Si3
InChI InChI=1S/C41H89NO3Si3/c1-12-14-16-18-20-22-24-25-27-28-30-32-34-36-40(45-48(9,10)11)39(38-44-47(6,7)8)42(46(3,4)5)41(43)37-35-33-31-29-26-23-21-19-17-15-13-2/h39-40H,12-38H2,1-11H3/t39-,40+/m0/s1
InChIKey LTEUWCKJSSWREY-IOLBBIBUSA-N
Molecular Weight 728.422 g/mol
SMILES C(CCC[C@]([C@](CO[Si](C)(C)C)(N(C(CCCCCCCCCCCCC)=O)[Si](C)(C)C)[H])(O[Si](C)(C)C)[H])CCCCCCCCCCC