| SpectraBase Compound ID | A2dJB686kz4 |
|---|---|
| InChI | InChI=1S/C9H6N6O4/c1-2-3-10-4-5(11-3)8-7(13-19-14(8)16)9-6(4)12-18-15(9)17/h2H2,1H3,(H,10,11) |
| InChIKey | JCALPTOBMSSINF-UHFFFAOYSA-N |
| Mol Weight | 262.18 g/mol |
| Molecular Formula | C9H6N6O4 |
| Exact Mass | 262.045053 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | a2erRj8r86 |
|---|---|
| Name | 7H-2,5-Dioxa-1,3,4,6,7,9-hexaazatrindene, 8-ethyl-, 3,6-dioxide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H6N6O4 |
| InChI | InChI=1S/C9H6N6O4/c1-2-3-10-4-5(11-3)8-7(13-19-14(8)16)9-6(4)12-18-15(9)17/h2H2,1H3,(H,10,11) |
| InChIKey | JCALPTOBMSSINF-UHFFFAOYSA-N |
| Molecular Weight | 262.185 g/mol |
| SMILES | [nH]1c(nc2c3c(c4no[n+](c4c12)[O-])[n+](on3)[O-])CC |
| SPLASH | splash10-0w29-5960000000-6a93b2cdf6b1315a56f6 |
| Wiley ID | 1439531 |