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(trans)-2-( Adenin-9'-ylmethyl)-4-hydroxymethyl-1,3-dioxolane
SpectraBase Compound ID D21I63TUWHA
InChI InChI=1S/C10H13N5O3/c11-9-8-10(13-4-12-9)15(5-14-8)1-7-17-3-6(2-16)18-7/h4-7,16H,1-3H2,(H2,11,12,13)/t6-,7-/m1/s1
InChIKey XZOKBTWMQWESAH-RNFRBKRXSA-N
Mol Weight 251.25 g/mol
Molecular Formula C10H13N5O3
Exact Mass 251.101839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OadHBNAwJH
Name (trans)-2-( Adenin-9'-ylmethyl)-4-hydroxymethyl-1,3-dioxolane
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Formula C10H13N5O3
InChI InChI=1S/C10H13N5O3/c11-9-8-10(13-4-12-9)15(5-14-8)1-7-17-3-6(2-16)18-7/h4-7,16H,1-3H2,(H2,11,12,13)/t6-,7-/m1/s1
InChIKey XZOKBTWMQWESAH-RNFRBKRXSA-N
Molecular Weight 251.246 g/mol
SMILES Nc1c2c([n](C[C@]3(O[C@](CO)(CO3)[H])[H])cn2)ncn1
SPLASH splash10-0pb9-9710000000-b93a4627f85283dc08d1
Source of Spectrum SB-46-1126-16
Synonyms (trans)-4-(Hydroxymethyl)-2-[adenin-9'-ylmethyl]-1,3-dioxolane {(2R,4R)-2-[(6-amino-9H-purin-9-yl)methyl]-1,3-dioxolan-4-yl}methanol
Wiley ID 1254288