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.alpha.,L-(2'S)-2',3'-Dideoxy-2'-trifluoromethyl-4'-thiocytidine
SpectraBase Compound ID 1xRjLxVte7A
InChI InChI=1S/C10H12F3N3O2S/c11-10(12,13)6-3-5(4-17)19-8(6)16-2-1-7(14)15-9(16)18/h1-2,5-6,8,17H,3-4H2,(H2,14,15,18)/t5-,6-,8-/m1/s1
InChIKey RTWABDXZTBWDNO-ATRFCDNQSA-N
Mol Weight 295.28 g/mol
Molecular Formula C10H12F3N3O2S
Exact Mass 295.060232 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDBHLAQOUIp
Name .alpha.,L-(2'S)-2',3'-Dideoxy-2'-trifluoromethyl-4'-thiocytidine
Comments Less than 3 mono-isotopic peaks
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Formula C10H12F3N3O2S
InChI InChI=1S/C10H12F3N3O2S/c11-10(12,13)6-3-5(4-17)19-8(6)16-2-1-7(14)15-9(16)18/h1-2,5-6,8,17H,3-4H2,(H2,14,15,18)/t5-,6-,8-/m1/s1
InChIKey RTWABDXZTBWDNO-ATRFCDNQSA-N
Molecular Weight 295.280 g/mol
SMILES OC[C@]1(C[C@]([C@](N2C=CC(=NC2=O)N)(S1)[H])(C(F)(F)F)[H])[H]
SPLASH splash10-03di-0900000000-cdd1da3cd7e6b0755b85
Source of Spectrum J-67-1019-10
Synonyms 4-amino-1-[(2R,3S,5R)-5-(hydroxymethyl)-3-(trifluoromethyl)-2-thiolanyl]-2-pyrimidinone 4-amino-1-[(2R,3S,5R)-5-(hydroxymethyl)-3-(trifluoromethyl)thiolan-2-yl]pyrimidin-2-one 4-amino-1-[(2R,3S,5R)-5-(hydroxymethyl)-3-(trifluoromethyl)tetrahydrothiophen-2-yl]pyrimidin-2-one 4-azanyl-1-[(2R,3S,5R)-5-(hydroxymethyl)-3-(trifluoromethyl)thiolan-2-yl]pyrimidin-2-one
Wiley ID 1569139