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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fUar9H2vwG
Name Thymidine, 5'-O-[(1,1-dimethylethyl)dimethylsilyl]-, 3'-(trifluoroacetate)
CAS Registry Number 56070-44-1
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(29-15(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 N1C(C(=CN(C1=O)[C@@]1(O[C@](CO[Si](C(C)(C)C)(C)C)([C@](C1)(OC(C(F)(F)F)=O)[H])[H])[H])C)=O
SPLASH splash10-001i-9721000000-8cc2759569be54e94118
Source of Spectrum 0-16-131-2
Synonyms (2R,3S,5R)-2-{[(tert-butyldimethylsilyl)oxy]methyl}-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-3-yl 2,2,2-trifluoroacetate 3'-O-trifluoroacetyl-5'-O-(tert-butyldimethylsilyl)thymidine
Wiley ID 1388113