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(2R,3S)-4-(6-aminopurin-9-yl)butane-1,2,3-triol
SpectraBase Compound ID DOMAAd7QkQf
InChI InChI=1S/C9H13N5O3/c10-8-7-9(12-3-11-8)14(4-13-7)1-5(16)6(17)2-15/h3-6,15-17H,1-2H2,(H2,10,11,12)/t5-,6+/m0/s1
InChIKey QKCTULZIZBZRBQ-NTSWFWBYSA-N
Mol Weight 239.24 g/mol
Molecular Formula C9H13N5O3
Exact Mass 239.101839 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IDLGfRycQn4
Name (2R,3S)-4-(6-aminopurin-9-yl)butane-1,2,3-triol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13N5O3
InChI InChI=1S/C9H13N5O3/c10-8-7-9(12-3-11-8)14(4-13-7)1-5(16)6(17)2-15/h3-6,15-17H,1-2H2,(H2,10,11,12)/t5-,6+/m0/s1
InChIKey QKCTULZIZBZRBQ-NTSWFWBYSA-N
Molecular Weight 239.235 g/mol
SMILES Nc1c2c([n](C[C@@]([C@@](CO)(O)[H])(O)[H])cn2)ncn1
SPLASH splash10-002s-0910000000-4c8f49e1972fb9720c58
Source of Spectrum KC-0-944-4
Synonyms (2R,3S)-4-adenin-9-ylbutane-1,2,3-triol 9-[(2S,3R)-2,3,4-Trihydroxybutyl]adenine
Wiley ID 824592