| SpectraBase Spectrum ID |
2QsTWvsPejj |
| Name |
(2R,3S,4R,5R)-2-(6-amino-9H-purin-9-yl)-4-bromo-5-(hydroxymethyl)oxolan-3-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H13BrClN5O3 |
| InChI |
InChI=1S/C10H12BrN5O3.ClH/c11-5-4(1-17)19-10(7(5)18)16-3-15-6-8(12)13-2-14-9(6)16;/h2-5,7,10,17-18H,1H2,(H2,12,13,14);1H/t4-,5+,7-,10-;/m1./s1 |
| InChIKey |
IWPBJTWSDKNHFU-NLJAMZKWSA-N |
| Molecular Weight |
366.603 g/mol |
| SMILES |
Cl.OC[C@]1(O[C@]([C@@]([C@]1(Br)[H])(O)[H])([n]1c2c(c(N)ncn2)nc1)[H])[H] |
| SPLASH |
splash10-001i-0009000000-a7269e0f62b34b1e7288 |
| Source of Spectrum |
OV-4-605-6 |
| Wiley ID |
1547591 |
