| SpectraBase Compound ID | 8qO0npjHZVM |
|---|---|
| InChI | InChI=1S/C12H13N3S/c1-15-8-4-7-11(15)14-12-13-9-5-2-3-6-10(9)16-12/h2-3,5-6H,4,7-8H2,1H3/b14-11+ |
| InChIKey | BHYVYMZSQDOZKO-SDNWHVSQSA-N |
| Mol Weight | 231.32 g/mol |
| Molecular Formula | C12H13N3S |
| Exact Mass | 231.083019 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GgHUNmzwGzb |
|---|---|
| Name | 2-Benzothiazolamine, N-(1-methyl-2-pyrrolidinylidene)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 231.083018605 u |
| Formula | C12H13N3S |
| InChI | InChI=1S/C12H13N3S/c1-15-8-4-7-11(15)14-12-13-9-5-2-3-6-10(9)16-12/h2-3,5-6H,4,7-8H2,1H3/b14-11+ |
| InChIKey | BHYVYMZSQDOZKO-SDNWHVSQSA-N |
| Molecular Weight | 231.317 g/mol |
| SMILES | C1N(\C(=N\C2=NC3=CC=CC=C3S2)CC1)C |