| SpectraBase Compound ID | 6MDqHa7hBsx |
|---|---|
| InChI | InChI=1S/C13H18N2S/c1-10-6-4-7-11(2)12(10)15(3)13-14-8-5-9-16-13/h4,6-7H,5,8-9H2,1-3H3 |
| InChIKey | XDAYGYVPJYBGJU-UHFFFAOYSA-N |
| Mol Weight | 234.36 g/mol |
| Molecular Formula | C13H18N2S |
| Exact Mass | 234.11907 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3gGRLcysm5R |
|---|---|
| Name | Xylazine me |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.119069762 u |
| Formula | C13H18N2S |
| InChI | InChI=1S/C13H18N2S/c1-10-6-4-7-11(2)12(10)15(3)13-14-8-5-9-16-13/h4,6-7H,5,8-9H2,1-3H3 |
| InChIKey | XDAYGYVPJYBGJU-UHFFFAOYSA-N |
| Molecular Weight | 234.361 g/mol |
| SMILES | C1(N(C=2SCCCN2)C)=C(C=CC=C1C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914541 |