| SpectraBase Compound ID | kbuno9dhOV |
|---|---|
| InChI | InChI=1S/C9H13NS/c1-2-3-8-11-9-4-6-10-7-5-9/h4-7H,2-3,8H2,1H3 |
| InChIKey | BJANPDOQTUMTHR-UHFFFAOYSA-N |
| Mol Weight | 167.27 g/mol |
| Molecular Formula | C9H13NS |
| Exact Mass | 167.076871 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LyeyOHqrfFU |
|---|---|
| Name | Pyridine, 4-(butylthio)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 167.076870597 u |
| Formula | C9H13NS |
| InChI | InChI=1S/C9H13NS/c1-2-3-8-11-9-4-6-10-7-5-9/h4-7H,2-3,8H2,1H3 |
| InChIKey | BJANPDOQTUMTHR-UHFFFAOYSA-N |
| Molecular Weight | 167.270 g/mol |
| SMILES | C(SC1=CC=NC=C1)CCC |