| SpectraBase Compound ID | 7SHlIbuQKYP |
|---|---|
| InChI | InChI=1S/C14H19N7O2/c1-21-7-8(19-13(22)9-2-3-12(17)20-9)6-10(21)14(23)18-5-4-11(15)16/h4-7,9H,2-3,15-16H2,1H3,(H2,17,20)(H,19,22)/b18-5+ |
| InChIKey | TUZMLDPJWIHNOC-BLLMUTORSA-N |
| Mol Weight | 317.35 g/mol |
| Molecular Formula | C14H19N7O2 |
| Exact Mass | 317.160023 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3ZOHePfNEk5 |
|---|---|
| Name | BRN 0498949 |
| CAS Registry Number | 37913-78-3 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H19N7O2 |
| InChI | InChI=1S/C14H19N7O2/c1-21-7-8(19-13(22)9-2-3-12(17)20-9)6-10(21)14(23)18-5-4-11(15)16/h4-7,9H,2-3,15-16H2,1H3,(H2,17,20)(H,19,22)/b18-5+ |
| InChIKey | TUZMLDPJWIHNOC-BLLMUTORSA-N |
| Molecular Weight | 317.353 g/mol |
| SMILES | N(c1cc(C(\N=C\C=C(N)N)=O)[n](c1)C)C(C1CCC(=N1)N)=O |
| SPLASH | splash10-001l-9310000000-9726185f3cc09ef3c704 |
| Source of Spectrum | W5-28527-0-0 |
| Wiley ID | 1317532 |