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(+-)-cis-9-[2-(Hydroxymethyl)cyclohexyl]adenine
SpectraBase Compound ID AXlxmX1cfN7
InChI InChI=1S/C12H17N5O/c13-11-10-12(15-6-14-11)17(7-16-10)9-4-2-1-3-8(9)5-18/h6-9,18H,1-5H2,(H2,13,14,15)/t8-,9-/m1/s1
InChIKey YEJNIDAYLNVPGM-RKDXNWHRSA-N
Mol Weight 247.3 g/mol
Molecular Formula C12H17N5O
Exact Mass 247.14331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2j3NwYhwIMP
Name (+-)-cis-9-[2-(Hydroxymethyl)cyclohexyl]adenine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17N5O
InChI InChI=1S/C12H17N5O/c13-11-10-12(15-6-14-11)17(7-16-10)9-4-2-1-3-8(9)5-18/h6-9,18H,1-5H2,(H2,13,14,15)/t8-,9-/m1/s1
InChIKey YEJNIDAYLNVPGM-RKDXNWHRSA-N
Molecular Weight 247.302 g/mol
SMILES Nc1c2c([n]([C@]3([C@@](CO)(CCCC3)[H])[H])cn2)ncn1
SPLASH splash10-000i-1930000000-d7df4e4f456df533d7a7
Source of Spectrum KC-61-476-4
Synonyms [(1S,2R)-2-(6-amino-9H-purin-9-yl)cyclohexyl]methanol
Wiley ID 1627126