![3-(ethylsulfanyl)-5,7-dimethylpyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione](/api/spectrum/CY2GEMsDp66/structure.png?h=300&w=458 "3-(ethylsulfanyl)-5,7-dimethylpyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione")
| SpectraBase Compound ID | DyIxzEbRjol |
|---|---|
| InChI | InChI=1S/C9H11N5O2S/c1-4-17-8-10-6-5(11-12-8)7(15)14(3)9(16)13(6)2/h4H2,1-3H3 |
| InChIKey | YMBKKPUNJHIQOY-UHFFFAOYSA-N |
| Mol Weight | 253.28 g/mol |
| Molecular Formula | C9H11N5O2S |
| Exact Mass | 253.063346 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CY2GEMsDp66 |
|---|---|
| Name | 3-(ethylsulfanyl)-5,7-dimethylpyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H11N5O2S |
| InChI | InChI=1S/C9H11N5O2S/c1-4-17-8-10-6-5(11-12-8)7(15)14(3)9(16)13(6)2/h4H2,1-3H3 |
| InChIKey | YMBKKPUNJHIQOY-UHFFFAOYSA-N |
| Molecular Weight | 253.280 g/mol |
| SMILES | c12N(C(N(C(c2nnc(n1)SCC)=O)C)=O)C |
| SPLASH | splash10-008a-9330000000-62cb3767eab3c5ea1970 |
| Synonyms | 3-(ethylthio)-5,7-dimethyl-pyrimido[4,5-e][1,2,4]triazine-6,8-quinone 3-(ethylthio)-5,7-dimethylpyrimido[4,5-e][1,2,4]triazine-6,8-dione 3-Ethylsulfanyl-5,7-dimethyl-pyrimido[4,5-e][1,2,4]triazine-6,8-dione Pyrimido[4,5-E][1,2,4]triazine-6,8(5H,7H)-dione, 3-(ethylthio)-5,7-dimethyl- |
| Wiley ID | 1448741 |