| SpectraBase Spectrum ID |
BIkuVU2szt8 |
| Name |
9-Benzyl-6-chloropurine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H9ClN4 |
| InChI |
InChI=1S/C12H9ClN4/c13-11-10-12(15-7-14-11)17(8-16-10)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2 |
| InChIKey |
NKEFCVAMNJICJZ-UHFFFAOYSA-N |
| Molecular Weight |
244.685 g/mol |
| SMILES |
c12[n](cnc2c(Cl)ncn1)Cc1ccccc1 |
| SPLASH |
splash10-0006-9060000000-631ff010030ca40c578c |
| Source of Spectrum |
F-50-9751-2 |
| Synonyms |
6-chloranyl-9-(phenylmethyl)purine
9-Benzyl-6-chloro-9H-purine
6-chloro-9-(phenylmethyl)purine
9-benzyl-6-chloro-purine |
| Wiley ID |
1246749 |
