| SpectraBase Compound ID | CbMHiYNI6AP |
|---|---|
| InChI | InChI=1S/C10H11ClS/c11-10-7-9-4-2-1-3-8(9)5-6-12-10/h1-4,10H,5-7H2 |
| InChIKey | ZQPQCODLKJDVGT-UHFFFAOYSA-N |
| Mol Weight | 198.71 g/mol |
| Molecular Formula | C10H11ClS |
| Exact Mass | 198.026999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 72a0QdvaID0 |
|---|---|
| Name | 3-BENZOTHIEPIN, 2-CHLORO-1,2,4,5-TETRAHYDRO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H11ClS |
| InChI | InChI=1S/C10H11ClS/c11-10-7-9-4-2-1-3-8(9)5-6-12-10/h1-4,10H,5-7H2 |
| InChIKey | ZQPQCODLKJDVGT-UHFFFAOYSA-N |
| Instrument Name | BRUKER WH-400 |
| Solvent | CHF2Cl |