| SpectraBase Compound ID | 52NYHU8BxZR |
|---|---|
| InChI | InChI=1S/C9H8IN3/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,(H3,11,12,13) |
| InChIKey | DLALNTSJBUVVDM-UHFFFAOYSA-N |
| Mol Weight | 285.09 g/mol |
| Molecular Formula | C9H8IN3 |
| Exact Mass | 284.976292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GDiqadz5QI3 |
|---|---|
| Name | 5-(4-Iodophenyl)-1H-pyrazol-3-amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.976292270 u |
| Formula | C9H8IN3 |
| InChI | InChI=1S/C9H8IN3/c10-7-3-1-6(2-4-7)8-5-9(11)13-12-8/h1-5H,(H3,11,12,13) |
| InChIKey | DLALNTSJBUVVDM-UHFFFAOYSA-N |
| Molecular Weight | 285.088 g/mol |
| SMILES | C=1(N)C=C(C2=CC=C(C=C2)I)NN1 |