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2-Cyano-9-[2-deoxy-.beta.-d-ribofuranosyl]adenine
SpectraBase Compound ID X1ja4Z8W9t
InChI InChI=1S/C11H12N6O3/c12-2-7-15-10(13)9-11(16-7)17(4-14-9)8-1-5(19)6(3-18)20-8/h4-6,8,18-19H,1,3H2,(H2,13,15,16)
InChIKey RMHCZHWFKVSINO-UHFFFAOYSA-N
Mol Weight 276.26 g/mol
Molecular Formula C11H12N6O3
Exact Mass 276.097088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jeB16dbNOH
Name 2-Cyano-9-[2-deoxy-.beta.-d-ribofuranosyl]adenine
CAS Registry Number 133548-35-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N6O3
InChI InChI=1S/C11H12N6O3/c12-2-7-15-10(13)9-11(16-7)17(4-14-9)8-1-5(19)6(3-18)20-8/h4-6,8,18-19H,1,3H2,(H2,13,15,16)
InChIKey RMHCZHWFKVSINO-UHFFFAOYSA-N
Molecular Weight 276.256 g/mol
SMILES OCC1OC(CC1O)[n]1c2c(c(nc(n2)C#N)N)nc1
SPLASH splash10-01po-9400000000-6d0f38d4e209047c563d
Source of Spectrum NP-8-6545-0
Synonyms 6-Amino-9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-purinecarbonitrile 6-Amino-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purine-2-carbonitrile 6-Amino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purine-2-carbonitrile 6-Azanyl-9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purine-2-carbonitrile
Wiley ID 1107479