| SpectraBase Compound ID | 1yNq40fqA2E |
|---|---|
| InChI | InChI=1S/C6H9BrOS/c1-4-2-5(3-7)9-6(4)8/h4-5H,2-3H2,1H3 |
| InChIKey | XDFPDMUVEGWOGJ-UHFFFAOYSA-N |
| Mol Weight | 209.1 g/mol |
| Molecular Formula | C6H9BrOS |
| Exact Mass | 207.955749 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LJ6k7sOQiVP |
|---|---|
| Name | trans-2-Methyl-4-bromomethyl-tetrahydro-2-thiophenone |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C6H9BrOS |
| InChI | InChI=1S/C6H9BrOS/c1-4-2-5(3-7)9-6(4)8/h4-5H,2-3H2,1H3 |
| InChIKey | XDFPDMUVEGWOGJ-UHFFFAOYSA-N |
| Instrument Name | Jeol FX-90 |
| Literature Reference | Y. Tamura, M. Mizutani, Y. Furukawa, J. Am. Chem. Soc. 106, 1079 (1984). |
| NMR Standard | CDCl3 |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |