| SpectraBase Compound ID | 6yzQtBQpeGh |
|---|---|
| InChI | InChI=1S/C13H10N4S/c1-2-4-12-11(3-1)16-13(18-12)17-15-9-10-5-7-14-8-6-10/h1-9H,(H,16,17)/b15-9+ |
| InChIKey | JLIFGFRXBLCQSK-OQLLNIDSSA-N |
| Mol Weight | 254.31 g/mol |
| Molecular Formula | C13H10N4S |
| Exact Mass | 254.062618 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HqgxaEHiMND |
|---|---|
| Name | Isonicotinaldehyde, (2-benzothiazolyl)hydrazone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.062617512 u |
| Formula | C13H10N4S |
| InChI | InChI=1S/C13H10N4S/c1-2-4-12-11(3-1)16-13(18-12)17-15-9-10-5-7-14-8-6-10/h1-9H,(H,16,17)/b15-9+ |
| InChIKey | JLIFGFRXBLCQSK-OQLLNIDSSA-N |
| Molecular Weight | 254.311 g/mol |
| SMILES | N(C1=NC=2C=CC=CC2S1)\N=C\C=1C=CN=CC1 |