| SpectraBase Spectrum ID |
4sgnHXUcsSf |
| Name |
9H-Purine, 9-(methyl-D3)-6-(methylthio)- |
| Alternate Name(s) |
S-methyl-N9-perdeuteriomethyl-6-mercaptopurine |
| CAS Registry Number |
62268-23-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H5D3N4S |
| InChI |
InChI=1S/C7H8N4S/c1-11-4-10-5-6(11)8-3-9-7(5)12-2/h3-4H,1-2H3/i1D3 |
| InChIKey |
WSHSHJGZEQTGJO-FIBGUPNXSA-N |
| Molecular Weight |
183.247 g/mol |
| SMILES |
c12nc[n](c2ncnc1SC)C([2D])([2D])[2D] |
| SPLASH |
splash10-001i-1900000000-97cdf0d78e0cac7ba6af |
| Source of Spectrum |
E-49-726-2 |
| Wiley ID |
1175783 |
