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9-[(1'.beta.,3'.alpha.,4'.beta.)-4'-(Diethylphosphono)methoxy-3'-hydroxycyclopentyl]-2-amino-6-chloropurine
SpectraBase Compound ID 87eq7TdQWVp
InChI InChI=1S/C15H23ClN5O5P/c1-3-25-27(23,26-4-2)8-24-11-6-9(5-10(11)22)21-7-18-12-13(16)19-15(17)20-14(12)21/h7,9-11,22H,3-6,8H2,1-2H3,(H2,17,19,20)/t9-,10-,11-/m0/s1
InChIKey AGFGHJHTQQVXAG-DCAQKATOSA-N
Mol Weight 419.81 g/mol
Molecular Formula C15H23ClN5O5P
Exact Mass 419.112534 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EHkjboDvH4
Name 9-[(1'.beta.,3'.alpha.,4'.beta.)-4'-(Diethylphosphono)methoxy-3'-hydroxycyclopentyl]-2-amino-6-chloropurine
Alternate Name(s) 9-[(1'.alpha.,3'.alpha.,4'.beta.)-4'-(Diethylphosphono)methoxy-3'-hydroxycyclopentyl]-2-amino-6-chloropurine Diethyl {[(1S,2S,4S)-4-(2-amino-6-chloro-9H-purin-9-yl)-2-hydroxycyclopentyl]oxy}methylphosphonate (1S,2S,4S)-4-(2-amino-6-chloro-9-purinyl)-2-(diethoxyphosphorylmethoxy)-1-cyclopentanol (1S,2S,4S)-4-(2-amino-6-chloropurin-9-yl)-2-(diethoxyphosphorylmethoxy)cyclopentan-1-ol (1S,2S,4S)-4-(2-azanyl-6-chloranyl-purin-9-yl)-2-(diethoxyphosphorylmethoxy)cyclopentan-1-ol
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Formula C15H23ClN5O5P
InChI InChI=1S/C15H23ClN5O5P/c1-3-25-27(23,26-4-2)8-24-11-6-9(5-10(11)22)21-7-18-12-13(16)19-15(17)20-14(12)21/h7,9-11,22H,3-6,8H2,1-2H3,(H2,17,19,20)/t9-,10-,11-/m0/s1
InChIKey AGFGHJHTQQVXAG-DCAQKATOSA-N
Molecular Weight 419.806 g/mol
SMILES Nc1nc(c2c([n]([C@]3(C[C@@]([C@](C3)(OCP(=O)(OCC)OCC)[H])(O)[H])[H])cn2)n1)Cl
SPLASH splash10-0g6r-0970000000-9e73c57f026fe60695c9
Source of Spectrum PS-0-2743-18
Wiley ID 786861