For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
6-Chloro-9-[(1R*,2R*,4S*,5R*)-3-oxatricyclo[3.2.1.0(2,4)]oct-1-yl]-9H-purine
SpectraBase Compound ID HSOInH4uuf1
InChI InChI=1S/C12H11ClN4O/c13-10-7-11(15-4-14-10)17(5-16-7)12-2-1-6(3-12)8-9(12)18-8/h4-6,8-9H,1-3H2/t6-,8+,9+,12-/m1/s1
InChIKey BRWXDKNMOJEGOP-NNXMZFEESA-N
Mol Weight 262.7 g/mol
Molecular Formula C12H11ClN4O
Exact Mass 262.062139 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3Vhh5Mx619A
Name 6-Chloro-9-[(1R*,2R*,4S*,5R*)-3-oxatricyclo[3.2.1.0(2,4)]oct-1-yl]-9H-purine
Alternate Name(s) 6-Chloro-9-((1R,2R,4S,5R)-3-oxatricyclo[3.2.1.0(2,4)]octan-1-yl)-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClN4O
InChI InChI=1S/C12H11ClN4O/c13-10-7-11(15-4-14-10)17(5-16-7)12-2-1-6(3-12)8-9(12)18-8/h4-6,8-9H,1-3H2/t6-,8+,9+,12-/m1/s1
InChIKey BRWXDKNMOJEGOP-NNXMZFEESA-N
Molecular Weight 262.700 g/mol
SMILES c12ncnc(c2nc[n]1[C@]12CC[C@@]([C@]3([C@@]2(O3)[H])[H])(C1)[H])Cl
SPLASH splash10-053r-0390000000-bdff123e1cacd8a8bca0
Source of Spectrum APC-347-478/SM21-37
Wiley ID 1769586