| SpectraBase Compound ID | Cx41GRCdvsZ |
|---|---|
| InChI | InChI=1S/C7H6ClN5S/c8-3-1-2-4-6(13-14-12-4)5(3)11-7(9)10/h1-2H,(H4,9,10,11) |
| InChIKey | SAPSJZRZNCXXTI-UHFFFAOYSA-N |
| Mol Weight | 227.67 g/mol |
| Molecular Formula | C7H6ClN5S |
| Exact Mass | 227.003244 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | wXAfxfguEq |
|---|---|
| Name | TIZANIDINE-METABOLITE 4 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H6ClN5S |
| InChI | InChI=1S/C7H6ClN5S/c8-3-1-2-4-6(13-14-12-4)5(3)11-7(9)10/h1-2H,(H4,9,10,11) |
| InChIKey | SAPSJZRZNCXXTI-UHFFFAOYSA-N |
| Instrument Name | GC |
| Molecular Weight | 227.673 g/mol |
| SMILES | N(C(=N)N)c1c(Cl)ccc2nsnc12 |
| SPLASH | splash10-01pc-7950000000-769ec5d8011df234e631 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |