| SpectraBase Compound ID | 10iFRK45pvi |
|---|---|
| InChI | InChI=1S/C12H14N2OS/c1-8-4-3-5-9(2)11(8)14-12-13-10(15)6-7-16-12/h3-5H,6-7H2,1-2H3,(H,13,14,15) |
| InChIKey | GMRGFRWIWTUUCH-UHFFFAOYSA-N |
| Mol Weight | 234.32 g/mol |
| Molecular Formula | C12H14N2OS |
| Exact Mass | 234.082684 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AxxtEmKXrWj |
|---|---|
| Name | Xylazine-m (oxo-) P526 |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.082684252 u |
| Formula | C12H14N2OS |
| InChI | InChI=1S/C12H14N2OS/c1-8-4-3-5-9(2)11(8)14-12-13-10(15)6-7-16-12/h3-5H,6-7H2,1-2H3,(H,13,14,15) |
| InChIKey | GMRGFRWIWTUUCH-UHFFFAOYSA-N |
| Molecular Weight | 234.317 g/mol |
| SMILES | C=1(C(NC2=NC(CCS2)=O)=C(C=CC1)C)C |