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1-Methylinosine, 3tms derivative

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1-Methylinosine, 3tms derivative
SpectraBase Compound ID KjfDTUkd9bO
InChI InChI=1S/C20H38N4O5Si3/c1-23-12-22-18-15(19(23)25)21-13-24(18)20-17(29-32(8,9)10)16(28-31(5,6)7)14(27-20)11-26-30(2,3)4/h12-14,16-17,20H,11H2,1-10H3/t14-,16-,17-,20-/m1/s1
InChIKey ODXCRJAYYNHPJP-WVSUBDOOSA-N
Mol Weight 498.8 g/mol
Molecular Formula C20H38N4O5Si3
Exact Mass 498.215 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DNxd4Wx5Ji5
Name 1-Methylinosine, 3tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 498.214999940 u
Formula C20H38N4O5Si3
InChI InChI=1S/C20H38N4O5Si3/c1-23-12-22-18-15(19(23)25)21-13-24(18)20-17(29-32(8,9)10)16(28-31(5,6)7)14(27-20)11-26-30(2,3)4/h12-14,16-17,20H,11H2,1-10H3/t14-,16-,17-,20-/m1/s1
InChIKey ODXCRJAYYNHPJP-WVSUBDOOSA-N
Molecular Weight 498.802 g/mol
SMILES [C@@]1(O[Si](C)(C)C)([C@@](O[C@@]([C@]1(O[Si](C)(C)C)[H])(CO[Si](C)(C)C)[H])(N1C2=C(C(=O)N(C=N2)C)N=C1)[H])[H]