| SpectraBase Compound ID | 3oZFKuEmLw6 |
|---|---|
| InChI | InChI=1S/C8H8ClN3O2/c9-5-7(13)11-12-8(14)6-1-3-10-4-2-6/h1-4H,5H2,(H,11,13)(H,12,14) |
| InChIKey | XCXQSUCTWQUXAV-UHFFFAOYSA-N |
| Mol Weight | 213.62 g/mol |
| Molecular Formula | C8H8ClN3O2 |
| Exact Mass | 213.030504 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FDTr5WsIqyr |
|---|---|
| Name | Isonicotinic acid N'-(2-chloro-acetyl)-hydrazide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.030504208 u |
| Formula | C8H8ClN3O2 |
| InChI | InChI=1S/C8H8ClN3O2/c9-5-7(13)11-12-8(14)6-1-3-10-4-2-6/h1-4H,5H2,(H,11,13)(H,12,14) |
| InChIKey | XCXQSUCTWQUXAV-UHFFFAOYSA-N |
| SMILES | C(C(=O)NNC(C1=CC=NC=C1)=O)Cl |