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((3aR,4R,6R,6aR)-6-(6-amino-9H-purin-9-yl)-2-methoxytetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methanol

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((3aR,4R,6R,6aR)-6-(6-amino-9H-purin-9-yl)-2-methoxytetrahydrofuro[3,4-d][1,3]dioxol-4-yl)methanol
SpectraBase Compound ID Gwbn7S64aC7
InChI InChI=1S/C12H15N5O5/c1-19-12-21-7-5(2-18)20-11(8(7)22-12)17-4-16-6-9(13)14-3-15-10(6)17/h3-5,7-8,11-12,18H,2H2,1H3,(H2,13,14,15)/t5-,7-,8-,11-,12?/m1/s1
InChIKey XYTSRLXNCZTCGP-MDNDXATMSA-N
Mol Weight 309.28 g/mol
Molecular Formula C12H15N5O5
Exact Mass 309.107319 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FH3Srs7Ho8l
Name ((3ar,4R,6R,6ar)-6-(6-Amino-9H-purin-9-yl)-2-methoxytetrahydrofuro[3,4-D][1,3]dioxol-4-yl)methanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.107318598 u
Formula C12H15N5O5
InChI InChI=1S/C12H15N5O5/c1-19-12-21-7-5(2-18)20-11(8(7)22-12)17-4-16-6-9(13)14-3-15-10(6)17/h3-5,7-8,11-12,18H,2H2,1H3,(H2,13,14,15)/t5-,7-,8-,11-,12?/m1/s1
InChIKey XYTSRLXNCZTCGP-MDNDXATMSA-N
SMILES NC=1C2=C(N([C@@]3(O[C@](CO)([C@@]4([C@]3(OC(O4)OC)[H])[H])[H])[H])C=N2)N=CN1