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.alpha.,D-(2'S)-2',3'-dideoxy-2'-trifluoromethylthymidine
SpectraBase Compound ID GQ1DHr9RNNc
InChI InChI=1S/C11H13F3N2O4/c1-5-3-16(10(19)15-8(5)18)9-7(11(12,13)14)2-6(4-17)20-9/h3,6-7,9,17H,2,4H2,1H3,(H,15,18,19)/t6-,7-,9-/m0/s1
InChIKey KTWCIDSJTGWKMH-ZKWXMUAHSA-N
Mol Weight 294.23 g/mol
Molecular Formula C11H13F3N2O4
Exact Mass 294.082741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qmqNwwsy6K
Name .alpha.,D-(2'S)-2',3'-dideoxy-2'-trifluoromethylthymidine
Comments Less than 3 mono-isotopic peaks
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Formula C11H13F3N2O4
InChI InChI=1S/C11H13F3N2O4/c1-5-3-16(10(19)15-8(5)18)9-7(11(12,13)14)2-6(4-17)20-9/h3,6-7,9,17H,2,4H2,1H3,(H,15,18,19)/t6-,7-,9-/m0/s1
InChIKey KTWCIDSJTGWKMH-ZKWXMUAHSA-N
Molecular Weight 294.230 g/mol
SMILES OC[C@@]1(C[C@@]([C@@](N2C(NC(C(=C2)C)=O)=O)(O1)[H])(C(F)(F)F)[H])[H]
SPLASH splash10-004i-0900000000-007db9bc141895942443
Source of Spectrum J-65-7081-20
Synonyms 1-[(2S,3S,5S)-5-(hydroxymethyl)-3-(trifluoromethyl)-2-oxolanyl]-5-methylpyrimidine-2,4-dione 1-[(2S,3S,5S)-5-(hydroxymethyl)-3-(trifluoromethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione 1-[(2S,3S,5S)-5-(hydroxymethyl)-3-(trifluoromethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione 1-[(2S,3S,5S)-5-(hydroxymethyl)-3-(trifluoromethyl)oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione
Wiley ID 1533527