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9-beta-D-Arabinofuranosyladenine

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 2 MS (GC)

9-beta-D-Arabinofuranosyladenine
SpectraBase Compound ID 2j0Rr3YLuVK
InChI InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7+,10-/m1/s1
InChIKey OIRDTQYFTABQOQ-UHTZMRCNSA-N
Mol Weight 267.25 g/mol
Molecular Formula C10H13N5O4
Exact Mass 267.096754 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bt5HEDmUY0I
Name 9H-Purin-6-amine, 9-.alpha.-D-xylofuranosyl-
CAS Registry Number 2946-52-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13N5O4
InChI InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7+,10-/m1/s1
InChIKey OIRDTQYFTABQOQ-UHTZMRCNSA-N
Molecular Weight 267.245 g/mol
SMILES Nc1c2c([n]([C@]3([C@]([C@@]([C@](O3)(CO)[H])(O)[H])(O)[H])[H])cn2)ncn1
SPLASH splash10-01p9-8900000000-fbbc751b5dbddada0586
Synonyms Adenine, 9-.alpha.-D-xylofuranosyl- 9-.alpha.-D-Xylofuranosyladenine (2R,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol (2R,5R)-2-(6-aminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Wiley ID 1437719