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Thymidine, 3'-O-[(1,1-dimethylethyl)dimethylsilyl]-, 5'-(trifluoroacetate)
SpectraBase Compound ID 5JtCemN2R98
InChI InChI=1S/C18H27F3N2O6Si/c1-10-8-23(16(26)22-14(10)24)13-7-11(29-30(5,6)17(2,3)4)12(28-13)9-27-15(25)18(19,20)21/h8,11-13H,7,9H2,1-6H3,(H,22,24,26)/t11-,12+,13+/m0/s1
InChIKey KSTXBZGMBOPNIW-YNEHKIRRSA-N
Mol Weight 452.5 g/mol
Molecular Formula C18H27F3N2O6Si
Exact Mass 452.159048 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AL6MNn5ekP2
Name Thymidine, 3'-O-[(1,1-dimethylethyl)dimethylsilyl]-, 5'-(trifluoroacetate)
CAS Registry Number 56070-43-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27F3N2O6Si
InChI InChI=1S/C18H27F3N2O6Si/c1-10-8-23(16(26)22-14(10)24)13-7-11(29-30(5,6)17(2,3)4)12(28-13)9-27-15(25)18(19,20)21/h8,11-13H,7,9H2,1-6H3,(H,22,24,26)/t11-,12+,13+/m0/s1
InChIKey KSTXBZGMBOPNIW-YNEHKIRRSA-N
Molecular Weight 452.502 g/mol
SMILES N1C(C(=CN(C1=O)[C@@]1(O[C@](COC(C(F)(F)F)=O)([C@](C1)(O[Si](C(C)(C)C)(C)C)[H])[H])[H])C)=O
SPLASH splash10-001i-9521000000-8fca055e14aa42982109
Source of Spectrum 0-16-131-2
Synonyms 3'-O-(tert-butyldimethylsilyl)-5'-O-trifluoroacetylthymidine [(2R,3S,5R)-3-[(tert-butyldimethylsilyl)oxy]-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methyl 2,2,2-trifluoroacetate
Wiley ID 1388112