| SpectraBase Compound ID | 5epc7yS7Fj |
|---|---|
| InChI | InChI=1S/C7H13N3O3/c1-3-13-6(11)4-5(2)9-10-7(8)12/h3-4H2,1-2H3,(H3,8,10,12)/b9-5+ |
| InChIKey | BSUHPUZHTUIERW-WEVVVXLNSA-N |
| Mol Weight | 187.2 g/mol |
| Molecular Formula | C7H13N3O3 |
| Exact Mass | 187.095691 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BWFQjBUVR0t |
|---|---|
| Name | Ethyl acetylacetate - N(2)-(aminocarbonyl)-hydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.095691288 u |
| Formula | C7H13N3O3 |
| InChI | InChI=1S/C7H13N3O3/c1-3-13-6(11)4-5(2)9-10-7(8)12/h3-4H2,1-2H3,(H3,8,10,12)/b9-5+ |
| InChIKey | BSUHPUZHTUIERW-WEVVVXLNSA-N |
| Molecular Weight | 187.199 g/mol |
| SMILES | C(N\N=C\(CC(=O)OCC)C)(=O)N |