| SpectraBase Spectrum ID |
E9OYCLP9XGx |
| Name |
1,9-Dibenzyl-6-(2-phenylethynyl)purin-2-one |
| Alternate Name(s) |
6-(2-phenylethynyl)-1,9-bis(phenylmethyl)-2-purinone
6-(2-phenylethynyl)-1,9-bis(phenylmethyl)purin-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H20N4O |
| InChI |
InChI=1S/C27H20N4O/c32-27-29-26-25(28-20-30(26)18-22-12-6-2-7-13-22)24(17-16-21-10-4-1-5-11-21)31(27)19-23-14-8-3-9-15-23/h1-15,20H,18-19H2 |
| InChIKey |
HKZCTOCPXOONCK-UHFFFAOYSA-N |
| Molecular Weight |
416.484 g/mol |
| SMILES |
C12=NC(N(C(=C2N=CN1Cc1ccccc1)C#Cc1ccccc1)Cc1ccccc1)=O |
| SPLASH |
splash10-0f6x-4109000000-bb598b1fa574202ab1e9 |
| Source of Spectrum |
F-52-12989-7 |
| Wiley ID |
799285 |
