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Thymidine, 5'-o-[(1,1-dimethylethyl)dimethylsilyl]-, 3'-(trifluoroacetate)

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Thymidine, 5'-o-[(1,1-dimethylethyl)dimethylsilyl]-, 3'-(trifluoroacetate)
SpectraBase Compound ID 41oYw9WPTrQ
InChI InChI=1S/C18H27F3N2O6Si/c1-10-8-23(16(26)22-14(10)24)13-7-11(29-15(25)18(19,20)21)12(28-13)9-27-30(5,6)17(2,3)4/h8,11-13H,7,9H2,1-6H3,(H,22,24,26)/t11-,12+,13+/m0/s1
InChIKey ZPISPNVTRZYNBS-YNEHKIRRSA-N
Mol Weight 452.5 g/mol
Molecular Formula C18H27F3N2O6Si
Exact Mass 452.159048 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AgaL9cRqCg
Name Thymidine, 5'-o-[(1,1-dimethylethyl)dimethylsilyl]-, 3'-(trifluoroacetate)
Comments Computed using HOSE algorithm
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Exact Mass 452.159047615 u
Formula C18H27F3N2O6Si
InChI InChI=1S/C18H27F3N2O6Si/c1-10-8-23(16(26)22-14(10)24)13-7-11(29-15(25)18(19,20)21)12(28-13)9-27-30(5,6)17(2,3)4/h8,11-13H,7,9H2,1-6H3,(H,22,24,26)/t11-,12+,13+/m0/s1
InChIKey ZPISPNVTRZYNBS-YNEHKIRRSA-N
Molecular Weight 452.502 g/mol
SMILES C1(N(C=C(C(N1)=O)C)[C@@]1(O[C@](CO[Si](C(C)(C)C)(C)C)([C@](C1)(OC(C(F)(F)F)=O)[H])[H])[H])=O