SpectraBase Spectrum ID |
8VL65AkSNQc |
Name |
4-Amino-7-(4-fluorophenyl)-3-methyl-5-(p-tolyl)-7H-pyrrolo[2,3-d]pyrimidin-3-ium iodide |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H18FIN4 |
InChI |
InChI=1S/C20H17FN4.HI/c1-13-3-5-14(6-4-13)17-11-25(16-9-7-15(21)8-10-16)20-18(17)19(22)24(2)12-23-20;/h3-12,22H,1-2H3;1H |
InChIKey |
OPRVJNABJBUKEK-UHFFFAOYSA-N |
Molecular Weight |
460.295 g/mol |
SMILES |
[I-].Nc1c2c(c[n](c2nc[n+]1C)-c1ccc(cc1)F)-c1ccc(cc1)C |
SPLASH |
splash10-001i-0009000000-9b806f01da3d27976fc0 |
Source of Spectrum |
G-75-828-8a |
Wiley ID |
1744637 |