| SpectraBase Spectrum ID |
5x7C6SA77YS |
| Name |
6-(4-methoxyphenyl)-9-(phenylmethyl)-2-(trifluoromethyl)purine |
| CAS Registry Number |
112779-02-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H15F3N4O |
| InChI |
InChI=1S/C20H15F3N4O/c1-28-15-9-7-14(8-10-15)16-17-18(26-19(25-16)20(21,22)23)27(12-24-17)11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3 |
| InChIKey |
CBQPIOLPGJJJNE-UHFFFAOYSA-N |
| Molecular Weight |
384.362 g/mol |
| SMILES |
c12c(nc[n]2Cc2ccccc2)c(-c2ccc(cc2)OC)nc(n1)C(F)(F)F |
| SPLASH |
splash10-0006-9004000000-42f0ea3ebacfad943a72 |
| Source of Spectrum |
Y-24-861-16 |
| Synonyms |
9-benzyl-6-(4-methoxyphenyl)-2-(trifluoromethyl)purine |
| Wiley ID |
1361435 |
