| SpectraBase Compound ID | KKNiC9vMiSe |
|---|---|
| InChI | InChI=1S/C9H9NOS/c11-9-5-6-12-8-4-2-1-3-7(8)10-9/h1-4H,5-6H2,(H,10,11) |
| InChIKey | VNUDPFLTWOKTKQ-UHFFFAOYSA-N |
| Mol Weight | 179.24 g/mol |
| Molecular Formula | C9H9NOS |
| Exact Mass | 179.040485 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7jGOa6pT4nf |
|---|---|
| Name | 2,3,4,5-Tetrahydro-1,5-benzothiazepin-4-on |
| CAS Registry Number | 53454-43-6 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C9H9NOS |
| InChI | InChI=1S/C9H9NOS/c11-9-5-6-12-8-4-2-1-3-7(8)10-9/h1-4H,5-6H2,(H,10,11) |
| InChIKey | VNUDPFLTWOKTKQ-UHFFFAOYSA-N |
| Literature Reference | Liebigs Ann. Chem. 869 (1985). |
| NMR Standard | not reported |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | DMSO-D6 |