| SpectraBase Compound ID | AkDENQJqcFC |
|---|---|
| InChI | InChI=1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | HNKJADCVZUBCPG-UHFFFAOYSA-N |
| Mol Weight | 124.2 g/mol |
| Molecular Formula | C7H8S |
| Exact Mass | 124.034671 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Dpthd1Ctvxh |
|---|---|
| Name | Thioanisole |
| CAS Registry Number | 100-68-5 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H8S |
| InChI | InChI=1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey | HNKJADCVZUBCPG-UHFFFAOYSA-N |
| Instrument Name | Varian XL-100 |
| Literature Reference | M.S. Chauhan, I.W. Still, Can. J. Chem. 53, 2880 (1975). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |