![7-Bromanyl-2,4-dimethyl-purino[8,7-b][1,3]thiazole-1,3-dione](/api/spectrum/5p9iKwllFqs/structure.png?h=300&w=458 "7-Bromanyl-2,4-dimethyl-purino[8,7-b][1,3]thiazole-1,3-dione")
| SpectraBase Compound ID | EMaav8IFG2Q |
|---|---|
| InChI | InChI=1S/C9H7BrN4O2S/c1-12-6-5(7(15)13(2)9(12)16)14-3-4(10)17-8(14)11-6/h3H,1-2H3 |
| InChIKey | MMCFWUGLFXHVJK-UHFFFAOYSA-N |
| Mol Weight | 315.15 g/mol |
| Molecular Formula | C9H7BrN4O2S |
| Exact Mass | 313.94731 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5p9iKwllFqs |
|---|---|
| Name | 7-Bromanyl-2,4-dimethyl-purino[8,7-b][1,3]thiazole-1,3-dione |
| CAS Registry Number | 79923-73-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H7BrN4O2S |
| InChI | InChI=1S/C9H7BrN4O2S/c1-12-6-5(7(15)13(2)9(12)16)14-3-4(10)17-8(14)11-6/h3H,1-2H3 |
| InChIKey | MMCFWUGLFXHVJK-UHFFFAOYSA-N |
| Molecular Weight | 315.145 g/mol |
| SMILES | c12c([n]3C=C(Sc3n2)Br)C(=O)N(C(N1C)=O)C |
| SPLASH | splash10-0400-9376000000-06c9c9497f1080d468d1 |
| Source of Spectrum | HC-17-951-0 |
| Synonyms | 7-Bromo-1,3-dimethylthiazolo[2,3-f]purine-2,4(1H,3H)-dione 7-Bromo-1,3-dimethyl[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione 7-Bromo-2,4-dimethyl-purino[8,7-b]thiazole-1,3-dione 7-Bromo-2,4-dimethyl-purino[8,7-b]thiazole-1,3-quinone 7-Bromo-2,4-dimethylpurino[8,7-b][1,3]thiazole-1,3-dione |
| Wiley ID | 1314544 |