| SpectraBase Compound ID | JIwJ9VHjttQ |
|---|---|
| InChI | InChI=1S/C9H13NS/c1-8-4-3-5-9(6-8,7-10)11-2/h4H,3,5-6H2,1-2H3 |
| InChIKey | JCTNABDYXKCMTO-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 | EqHDtddevSn |
|---|---|
| Name | 1-Cyano-3-methyl-1-thiomethyl-3-cyclohexene |
| CAS Registry Number | 82297-13-0 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C9H13NS |
| InChI | InChI=1S/C9H13NS/c1-8-4-3-5-9(6-8,7-10)11-2/h4H,3,5-6H2,1-2H3 |
| InChIKey | JCTNABDYXKCMTO-UHFFFAOYSA-N |
| Instrument Name | SF = 200 MHz |
| Literature Reference | Tetrahedron 42, 3871 (1986). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |