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(2'R)-L-N(4)-Benzoyl-5'-O-(tert-butyldimethylsilyl)-2',3'-dideoxy-2'-trifluoromethyl-4'-thiocytidine
SpectraBase Compound ID EP4IEEvZF18
InChI InChI=1S/C23H30F3N3O3SSi/c1-22(2,3)34(4,5)32-14-16-13-17(23(24,25)26)20(33-16)29-12-11-18(28-21(29)31)27-19(30)15-9-7-6-8-10-15/h6-12,16-17,20H,13-14H2,1-5H3,(H,27,28,30,31)/t16-,17-,20+/m0/s1
InChIKey WBBCMXOYRRZMGW-ABSDTBQOSA-N
Mol Weight 513.65 g/mol
Molecular Formula C23H30F3N3O3SSi
Exact Mass 513.172924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMY8XBAFBQV
Name (2'R)-L-N(4)-Benzoyl-5'-O-(tert-butyldimethylsilyl)-2',3'-dideoxy-2'-trifluoromethyl-4'-thiocytidine
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30F3N3O3SSi
InChI InChI=1S/C23H30F3N3O3SSi/c1-22(2,3)34(4,5)32-14-16-13-17(23(24,25)26)20(33-16)29-12-11-18(28-21(29)31)27-19(30)15-9-7-6-8-10-15/h6-12,16-17,20H,13-14H2,1-5H3,(H,27,28,30,31)/t16-,17-,20+/m0/s1
InChIKey WBBCMXOYRRZMGW-ABSDTBQOSA-N
Molecular Weight 513.651 g/mol
SMILES N(C=1C=CN([C@]2([C@@](C(F)(F)F)(C[C@](S2)(CO[Si](C(C)(C)C)(C)C)[H])[H])[H])C(N1)=O)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900300000-bf73fb0c5b00c916287e
Source of Spectrum J-67-1019-9
Synonyms N-{1-[(2R,3R,5S)-5-{[(tert-butyldimethylsilyl)oxy]methyl}-3-(trifluoromethyl)thiolan-2-yl]-2-oxo-1,2-dihydropyrimidin-4-yl}benzamide
Wiley ID 1569140