| SpectraBase Compound ID | C5QMjSJh5fa |
|---|---|
| InChI | InChI=1S/C13H15N3OS/c1-10(17)15-6-8-16(9-7-15)13-14-11-4-2-3-5-12(11)18-13/h2-5H,6-9H2,1H3 |
| InChIKey | HRYGRKJPINOEEB-UHFFFAOYSA-N |
| Mol Weight | 261.34 g/mol |
| Molecular Formula | C13H15N3OS |
| Exact Mass | 261.093583 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ikwcvt7Mtdh |
|---|---|
| Name | 2-(4-Acetyl-1-piperazinyl)-1,3-benzothiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.093583288 u |
| Formula | C13H15N3OS |
| InChI | InChI=1S/C13H15N3OS/c1-10(17)15-6-8-16(9-7-15)13-14-11-4-2-3-5-12(11)18-13/h2-5H,6-9H2,1H3 |
| InChIKey | HRYGRKJPINOEEB-UHFFFAOYSA-N |
| Molecular Weight | 261.343 g/mol |
| SMILES | C1(=NC=2C=CC=CC2S1)N1CCN(CC1)C(=O)C |