| SpectraBase Compound ID | 2zWTi1Be5Se |
|---|---|
| InChI | InChI=1S/C8H6OS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-4H,5H2 |
| InChIKey | ADHAJDDBRUOZHJ-UHFFFAOYSA-N |
| Mol Weight | 150.19 g/mol |
| Molecular Formula | C8H6OS |
| Exact Mass | 150.013936 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7AwQ1pvghkp |
|---|---|
| Name | 1-Thiaindan-3-one |
| CAS Registry Number | 130-03-0 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H6OS |
| InChI | InChI=1S/C8H6OS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-4H,5H2 |
| InChIKey | ADHAJDDBRUOZHJ-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 |