SpectraBase Compound ID | 7Wy7dWu3M3R |
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InChI | InChI=1S/C10H15NS/c1-10(2,3)12-8-9-6-4-5-7-11-9/h4-7H,8H2,1-3H3 |
InChIKey | MUYGHECDSGHWQJ-UHFFFAOYSA-N |
Mol Weight | 181.3 g/mol |
Molecular Formula | C10H15NS |
Exact Mass | 181.092521 g/mol |
SpectraBase Spectrum ID | Azsg3LuX7hV |
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Name | Pyridine, 2-[[(1,1-dimethylethyl)thio]methyl]- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 181.092520661 u |
Formula | C10H15NS |
InChI | InChI=1S/C10H15NS/c1-10(2,3)12-8-9-6-4-5-7-11-9/h4-7H,8H2,1-3H3 |
InChIKey | MUYGHECDSGHWQJ-UHFFFAOYSA-N |
Molecular Weight | 181.297 g/mol |
SMILES | C(SC(C)(C)C)C1=CC=CC=N1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.912706 |