![5-Chloro-7-methyl-2-methylthio-1,2,4-triazolo[1,5-a]pyrimidine](/api/spectrum/Eq8wMnRv2u1/structure.png?h=300&w=458 "5-Chloro-7-methyl-2-methylthio-1,2,4-triazolo[1,5-a]pyrimidine")
| SpectraBase Compound ID | 8s1Ptphuqbs |
|---|---|
| InChI | InChI=1S/C7H7ClN4S/c1-4-3-5(8)12-6(9-4)10-7(11-12)13-2/h3H,1-2H3 |
| InChIKey | QEFWPDVSBZHJOK-UHFFFAOYSA-N |
| Mol Weight | 214.67 g/mol |
| Molecular Formula | C7H7ClN4S |
| Exact Mass | 214.007995 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Eq8wMnRv2u1 |
|---|---|
| Name | 5-Chloro-7-methyl-2-methylthio-1,2,4-triazolo[1,5-a]pyrimidine |
| Alternate Name(s) | 5-chloranyl-7-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine 5-chloro-7-methyl-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine 5-chloro-7-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl methyl sulfide 7-Chloro-5-methyl-2-methylthio-1,2,4-triazolo[1,5-a]pyrimidine 7-chloro-5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine 7-chloranyl-5-methyl-2-methylsulfanyl-[1,2,4]triazolo[1,5-a]pyrimidine |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H7ClN4S |
| InChI | InChI=1S/C7H7ClN4S/c1-4-3-5(8)12-6(9-4)10-7(11-12)13-2/h3H,1-2H3 |
| InChIKey | QEFWPDVSBZHJOK-UHFFFAOYSA-N |
| Molecular Weight | 214.674 g/mol |
| SMILES | c12[n](nc(n2)SC)C(=CC(=N1)C)Cl |
| SPLASH | splash10-02t9-0490000000-e431d02608a7fe2c0558 |
| Source of Spectrum | Y-34-1521-4 |
| Wiley ID | 1212954 |