| SpectraBase Compound ID | 5NMcIe3aSsn |
|---|---|
| InChI | InChI=1S/C5H6I2N2/c1-2-9-5(7)4(6)3-8-9/h3H,2H2,1H3 |
| InChIKey | OMTDFXCOAHBPQC-UHFFFAOYSA-N |
| Mol Weight | 347.93 g/mol |
| Molecular Formula | C5H6I2N2 |
| Exact Mass | 347.862038 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9g3dNT26fz6 |
|---|---|
| Name | 1-Ethyl-4,5-diiodopyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 347.862038201 u |
| Formula | C5H6I2N2 |
| InChI | InChI=1S/C5H6I2N2/c1-2-9-5(7)4(6)3-8-9/h3H,2H2,1H3 |
| InChIKey | OMTDFXCOAHBPQC-UHFFFAOYSA-N |
| Molecular Weight | 347.926 g/mol |
| SMILES | CCN1C(=C(C=N1)I)I |