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7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 7-(3-deoxy-3-iodo-.beta.-D-xylofuranosyl)-
SpectraBase Compound ID AuT5bOdi7y0
InChI InChI=1S/C11H13IN4O3/c12-7-6(3-17)19-11(8(7)18)16-2-1-5-9(13)14-4-15-10(5)16/h1-2,4,6-8,11,17-18H,3H2,(H2,13,14,15)/t6-,7+,8-,11-/m1/s1
InChIKey RXZYEULNFBVRBB-FBSDJGSXSA-N
Mol Weight 376.15 g/mol
Molecular Formula C11H13IN4O3
Exact Mass 376.003235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Enbu240lADh
Name 7H-Pyrrolo[2,3-d]pyrimidin-4-amine, 7-(3-deoxy-3-iodo-.beta.-D-xylofuranosyl)-
CAS Registry Number 64526-27-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13IN4O3
InChI InChI=1S/C11H13IN4O3/c12-7-6(3-17)19-11(8(7)18)16-2-1-5-9(13)14-4-15-10(5)16/h1-2,4,6-8,11,17-18H,3H2,(H2,13,14,15)/t6-,7+,8-,11-/m1/s1
InChIKey RXZYEULNFBVRBB-FBSDJGSXSA-N
Molecular Weight 376.154 g/mol
SMILES OC[C@]1(O[C@]([C@@]([C@]1(I)[H])(O)[H])([n]1c2c(c(N)ncn2)cc1)[H])[H]
SPLASH splash10-001i-0910000000-d7ccfa956284805833a1
Source of Spectrum I-55-1264-0
Synonyms (2R,3S,4R,5R)-2-{4-amino-7H-pyrrolo[2,3-d]pyrimidin-7-yl}-5-(hydroxymethyl)-4-iodooxolan-3-ol 4-Amino-7-(3-iodo-3-deoxy-.beta.-D-xylofuranosyl)pyrrolo[2,3-d]pyrimidine
Wiley ID 1357384