| SpectraBase Compound ID | CFdW2xNwOMG |
|---|---|
| InChI | InChI=1S/C11H11ClN2/c12-7-9-14-8-6-11(13-14)10-4-2-1-3-5-10/h1-6,8H,7,9H2 |
| InChIKey | XGHRIDPONQFQLI-UHFFFAOYSA-N |
| Mol Weight | 206.68 g/mol |
| Molecular Formula | C11H11ClN2 |
| Exact Mass | 206.061076 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1wbzydh8fA1 |
|---|---|
| Name | 1-(2-Chloroethyl)-3-phenylpyrazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.061076062 u |
| Formula | C11H11ClN2 |
| InChI | InChI=1S/C11H11ClN2/c12-7-9-14-8-6-11(13-14)10-4-2-1-3-5-10/h1-6,8H,7,9H2 |
| InChIKey | XGHRIDPONQFQLI-UHFFFAOYSA-N |
| Molecular Weight | 206.676 g/mol |
| SMILES | C1=CC=C(C=2C=CN(N2)CCCl)C=C1 |