| SpectraBase Compound ID | 6YARjKQvvuk |
|---|---|
| InChI | InChI=1S/C9H12N4O3/c1-4-13-7(14)5-6(12(3)9(13)16)10-8(15)11(5)2/h4H2,1-3H3,(H,10,15) |
| InChIKey | JJEIWOXMYBJSHV-UHFFFAOYSA-N |
| Mol Weight | 224.22 g/mol |
| Molecular Formula | C9H12N4O3 |
| Exact Mass | 224.09094 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6cmXZMZLRel |
|---|---|
| Name | 1-Ethyl-3,7-dimethyl-9H-purine-2,6,8-trione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H12N4O3 |
| InChI | InChI=1S/C9H12N4O3/c1-4-13-7(14)5-6(12(3)9(13)16)10-8(15)11(5)2/h4H2,1-3H3,(H,10,15) |
| InChIKey | JJEIWOXMYBJSHV-UHFFFAOYSA-N |
| Molecular Weight | 224.220 g/mol |
| SMILES | N1C(N(C=2C(N(C(N(C12)C)=O)CC)=O)C)=O |
| SPLASH | splash10-00si-9240000000-ec8682064f5f20f0203f |
| Source of Spectrum | KC-0-679-25 |
| Wiley ID | 827623 |