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1-.beta.-D-(O2,2-Cyclo-arabinofuranosyl)-5-bromouracil
SpectraBase Compound ID 81yA8Fv3sZ5
InChI InChI=1S/C9H9BrN2O5/c10-3-1-12-8-6(5(14)4(2-13)16-8)17-9(12)11-7(3)15/h1,4-6,8,13-14H,2H2/t4-,5-,6+,8-/m1/s1
InChIKey YFVXKXAHEUOTJQ-MNCSTQPFSA-N
Mol Weight 305.08 g/mol
Molecular Formula C9H9BrN2O5
Exact Mass 303.969484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zBmIbfvSi0
Name 1-.beta.-D-(O2,2-Cyclo-arabinofuranosyl)-5-bromouracil
Alternate Name(s) (2R,3R,3aS,9aR)-7-bromo-3-hydroxy-2-(hydroxymethyl)-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-6-one
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Formula C9H9BrN2O5
InChI InChI=1S/C9H9BrN2O5/c10-3-1-12-8-6(5(14)4(2-13)16-8)17-9(12)11-7(3)15/h1,4-6,8,13-14H,2H2/t4-,5-,6+,8-/m1/s1
InChIKey YFVXKXAHEUOTJQ-MNCSTQPFSA-N
Molecular Weight 305.084 g/mol
SMILES OC[C@]1(O[C@@]2([C@]([C@@]1(O)[H])(OC=1N2C=C(C(N1)=O)Br)[H])[H])[H]
SPLASH splash10-014i-0988000000-c5d3ea7c4b0efbec2eb5
Source of Spectrum KO-9-227-1
Wiley ID 1305909