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2'-O-METHYL-6-THIOINOSINE
SpectraBase Compound ID 6veAaUvzUsT
InChI InChI=1S/C11H14N4O4S/c1-18-8-7(17)5(2-16)19-11(8)15-4-14-6-9(15)12-3-13-10(6)20/h3-5,7-8,11,16-17H,2H2,1H3,(H,12,13,20)/t5-,7-,8-,11-/m1/s1
InChIKey SOROVCDOYSTJKB-IOSLPCCCSA-N
Mol Weight 298.32 g/mol
Molecular Formula C11H14N4O4S
Exact Mass 298.073576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFg5UWvGhF0
Name 9-(2'-O-Methyl-.beta.-D-ribofuranosyl)purine-6-thione
Alternate Name(s) 9-[(2R,3R,4R,5R)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]-6,9-dihydro-1H-purine-6-thione
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Formula C11H14N4O4S
InChI InChI=1S/C11H14N4O4S/c1-18-8-7(17)5(2-16)19-11(8)15-4-14-6-9(15)12-3-13-10(6)20/h3-5,7-8,11,16-17H,2H2,1H3,(H,12,13,20)/t5-,7-,8-,11-/m1/s1
InChIKey SOROVCDOYSTJKB-IOSLPCCCSA-N
Molecular Weight 298.317 g/mol
SMILES N1C(c2c([n]([C@@]3(O[C@](CO)([C@]([C@]3(OC)[H])(O)[H])[H])[H])cn2)N=C1)=S
SPLASH splash10-0udi-1920000000-e3387fdb7e8f9f503f96
Source of Spectrum J-39-1891-2
Wiley ID 848781