![2-[1-(4-Piperonyl)piperazinyl)]benzothiazole](/api/spectrum/F97kT2apHhf/structure.png?h=300&w=458 "2-[1-(4-Piperonyl)piperazinyl)]benzothiazole")
| SpectraBase Compound ID | 2FMFeYDrCye |
|---|---|
| InChI | InChI=1S/C19H19N3O2S/c1-2-4-18-15(3-1)20-19(25-18)22-9-7-21(8-10-22)12-14-5-6-16-17(11-14)24-13-23-16/h1-6,11H,7-10,12-13H2 |
| InChIKey | BYHKGNWKJMGHGE-UHFFFAOYSA-N |
| Mol Weight | 353.44 g/mol |
| Molecular Formula | C19H19N3O2S |
| Exact Mass | 353.119798 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F97kT2apHhf |
|---|---|
| Name | 2-[1-(4-Piperonyl)piperazinyl)]benzothiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 353.119798036 u |
| Formula | C19H19N3O2S |
| InChI | InChI=1S/C19H19N3O2S/c1-2-4-18-15(3-1)20-19(25-18)22-9-7-21(8-10-22)12-14-5-6-16-17(11-14)24-13-23-16/h1-6,11H,7-10,12-13H2 |
| InChIKey | BYHKGNWKJMGHGE-UHFFFAOYSA-N |
| Molecular Weight | 353.440 g/mol |
| SMILES | C1(=NC2=CC=CC=C2S1)N1CCN(CC1)CC=1C=C2OCOC2=CC1 |