| SpectraBase Compound ID | 6rnz6wS5AK |
|---|---|
| InChI | InChI=1S/C7H4N2OS/c10-5-1-3-6-7(4-2-5)9-11-8-6/h1-4H |
| InChIKey | RSLFRAXZZBOTRA-UHFFFAOYSA-N |
| Mol Weight | 164.18 g/mol |
| Molecular Formula | C7H4N2OS |
| Exact Mass | 164.004434 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5m4xpAlBsqb |
|---|---|
| Name | 2,1,3-Cyclohepta(C)thiadiazol-6-one |
| CAS Registry Number | 85122-40-3 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H4N2OS |
| InChI | InChI=1S/C7H4N2OS/c10-5-1-3-6-7(4-2-5)9-11-8-6/h1-4H |
| InChIKey | RSLFRAXZZBOTRA-UHFFFAOYSA-N |
| Literature Reference | G. Seitz, H.S. The, Chemiker-Zeitung 106, 411 (1982). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |