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(+-)-(1R*,5R*,6S*,7S*)-{7-[6'-(Diacetylamino)-9'H-purin-9'-yl]-3-oxabicyclo[3.3.0]oct-6-yl}methyl acetate
SpectraBase Compound ID 4satWigCWGo
InChI InChI=1S/C19H23N5O5/c1-10(25)24(11(2)26)19-17-18(20-8-21-19)23(9-22-17)16-4-13-5-28-6-14(13)15(16)7-29-12(3)27/h8-9,13-16H,4-7H2,1-3H3/t13-,14+,15-,16-/m0/s1
InChIKey KDWXHPWOMNDWBD-FZKCQIBNSA-N
Mol Weight 401.42 g/mol
Molecular Formula C19H23N5O5
Exact Mass 401.169919 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dhxmr1EfQr
Name (+-)-(1R*,5R*,6S*,7S*)-{7-[6'-(Diacetylamino)-9'H-purin-9'-yl]-3-oxabicyclo[3.3.0]oct-6-yl}methyl acetate
Alternate Name(s) {(3aR,4S,5S,6aR)-5-[6-(diacetylamino)-9H-purin-9-yl]hexahydro-1H-cyclopenta[c]furan-4-yl}methyl acetate
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Formula C19H23N5O5
InChI InChI=1S/C19H23N5O5/c1-10(25)24(11(2)26)19-17-18(20-8-21-19)23(9-22-17)16-4-13-5-28-6-14(13)15(16)7-29-12(3)27/h8-9,13-16H,4-7H2,1-3H3/t13-,14+,15-,16-/m0/s1
InChIKey KDWXHPWOMNDWBD-FZKCQIBNSA-N
Molecular Weight 401.423 g/mol
SMILES c12[n](cnc2c(N(C(=O)C)C(=O)C)ncn1)[C@@]1([C@]([C@@]2(COC[C@@]2(C1)[H])[H])(COC(=O)C)[H])[H]
SPLASH splash10-03di-1229000000-6c8fdcd6d2ac723c5072
Source of Spectrum C5-2004-1993-16
Wiley ID 1617112