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[(4R,5S)-5-(adenin-9-ylmethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
SpectraBase Compound ID 6RguK6LHN5u
InChI InChI=1S/C12H17N5O3/c1-12(2)19-7(8(4-18)20-12)3-17-6-16-9-10(13)14-5-15-11(9)17/h5-8,18H,3-4H2,1-2H3,(H2,13,14,15)/t7-,8+/m0/s1
InChIKey SPXMBAQNKYIIRA-JGVFFNPUSA-N
Mol Weight 279.3 g/mol
Molecular Formula C12H17N5O3
Exact Mass 279.133139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2pDHyvJAQY
Name [(4R,5S)-5-(adenin-9-ylmethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
Alternate Name(s) [(4R,5S)-5-[(6-aminopurin-9-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
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Formula C12H17N5O3
InChI InChI=1S/C12H17N5O3/c1-12(2)19-7(8(4-18)20-12)3-17-6-16-9-10(13)14-5-15-11(9)17/h5-8,18H,3-4H2,1-2H3,(H2,13,14,15)/t7-,8+/m0/s1
InChIKey SPXMBAQNKYIIRA-JGVFFNPUSA-N
Molecular Weight 279.300 g/mol
SMILES Nc1c2c([n](C[C@@]3(OC(O[C@@]3(CO)[H])(C)C)[H])cn2)ncn1
SPLASH splash10-0f7a-0490000000-97fe3fccca1526839a24
Source of Spectrum KC-0-943-3
Wiley ID 824595