| SpectraBase Compound ID | IPu8VHOXtfu |
|---|---|
| InChI | InChI=1S/C9H15N3O2/c1-6-8(12(13)14)7(2)11(10-6)9(3,4)5/h1-5H3 |
| InChIKey | AUWIZBBCAAIBKM-UHFFFAOYSA-N |
| Mol Weight | 197.24 g/mol |
| Molecular Formula | C9H15N3O2 |
| Exact Mass | 197.116427 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 862Sx9O4HSN |
|---|---|
| Name | 1-Tert-butyl-3,5-dimethyl-4-nitropyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.116426733 u |
| Formula | C9H15N3O2 |
| InChI | InChI=1S/C9H15N3O2/c1-6-8(12(13)14)7(2)11(10-6)9(3,4)5/h1-5H3 |
| InChIKey | AUWIZBBCAAIBKM-UHFFFAOYSA-N |
| Molecular Weight | 197.238 g/mol |
| SMILES | N(=O)(=O)C1=C(N(N=C1C)C(C)(C)C)C |