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(+-)-(1R*,5R*,6S*,7S*)-[7-(6'-Chloro-9'H-purin-9'-yl)-3-oxabicyclo[3.3.0]oct-6-yl]methanol
SpectraBase Compound ID 2JZPQ97oJdh
InChI InChI=1S/C13H15ClN4O2/c14-12-11-13(16-5-15-12)18(6-17-11)10-1-7-3-20-4-9(7)8(10)2-19/h5-10,19H,1-4H2/t7-,8-,9+,10-/m0/s1
InChIKey YXFYZJXAWRCKQZ-QEYWKRMJSA-N
Mol Weight 294.74 g/mol
Molecular Formula C13H15ClN4O2
Exact Mass 294.088353 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2atCbzCKsQU
Name (+-)-(1R*,5R*,6S*,7S*)-[7-(6'-Chloro-9'H-purin-9'-yl)-3-oxabicyclo[3.3.0]oct-6-yl]methanol
Alternate Name(s) [(3aR,4S,5S,6aR)-5-(6-chloro-9H-purin-9-yl)hexahydro-1H-cyclopenta[c]furan-4-yl]methanol
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Formula C13H15ClN4O2
InChI InChI=1S/C13H15ClN4O2/c14-12-11-13(16-5-15-12)18(6-17-11)10-1-7-3-20-4-9(7)8(10)2-19/h5-10,19H,1-4H2/t7-,8-,9+,10-/m0/s1
InChIKey YXFYZJXAWRCKQZ-QEYWKRMJSA-N
Molecular Weight 294.742 g/mol
SMILES OC[C@@]1([C@@]([n]2c3c(c(Cl)ncn3)nc2)(C[C@]2(COC[C@@]12[H])[H])[H])[H]
SPLASH splash10-0a6r-7960000000-4e033e9bdfcabd298236
Source of Spectrum C5-2004-1993-12
Wiley ID 1617116