| SpectraBase Compound ID | ClErDektKxJ |
|---|---|
| InChI | InChI=1S/C7H8N4S/c1-11-4-10-6-5(11)7(12-2)9-3-8-6/h3-4H,1-2H3/i2D3 |
| InChIKey | WGZQCBOLSZNNRW-BMSJAHLVSA-N |
| Mol Weight | 183.25 g/mol |
| Molecular Formula | C7H52D3N4S |
| Exact Mass | 183.065798 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | B0nOd6YbyFL |
|---|---|
| Name | 7-Methyl-6-D3-methylthiopurine |
| CAS Registry Number | 33312-95-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H5D3N4S |
| InChI | InChI=1S/C7H8N4S/c1-11-4-10-6-5(11)7(12-2)9-3-8-6/h3-4H,1-2H3/i2D3 |
| InChIKey | WGZQCBOLSZNNRW-BMSJAHLVSA-N |
| Molecular Weight | 183.247 g/mol |
| SMILES | c12nc[n](c2c(SC([2D])([2D])[2D])ncn1)C |
| SPLASH | splash10-001i-4900000000-02c41000f19c052d6331 |
| Source of Spectrum | O-5-284-3 |
| Wiley ID | 17997 |