| SpectraBase Compound ID | 93pUljJLPHn |
|---|---|
| InChI | InChI=1S/C8H7N5OS/c14-7-5-10-13-8(11-7)12-9-4-6-2-1-3-15-6/h1-5H,(H2,11,12,13,14)/b9-4+ |
| InChIKey | JWZRAWWJPVPPST-RUDMXATFSA-N |
| Mol Weight | 221.24 g/mol |
| Molecular Formula | C8H7N5OS |
| Exact Mass | 221.037131 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D58EOku4kHx |
|---|---|
| Name | 2-Thiophenecarboxaldehyde, (4,5-dihydro-5-oxo-1,2,4-triazin-3-yl)hydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.037131038 u |
| Formula | C8H7N5OS |
| InChI | InChI=1S/C8H7N5OS/c14-7-5-10-13-8(11-7)12-9-4-6-2-1-3-15-6/h1-5H,(H2,11,12,13,14)/b9-4+ |
| InChIKey | JWZRAWWJPVPPST-RUDMXATFSA-N |
| SMILES | N(\N=C\C=1SC=CC1)C=1NC(C=NN1)=O |