![2-[2-Pyridylthio]-5-nitrothiazole](/api/spectrum/I1hcM5WyCCR/structure.png?h=300&w=458 "2-[2-Pyridylthio]-5-nitrothiazole")
| SpectraBase Compound ID | LFDmmttIKp1 |
|---|---|
| InChI | InChI=1S/C8H5N3O2S2/c12-11(13)7-5-10-8(15-7)14-6-3-1-2-4-9-6/h1-5H |
| InChIKey | BCZPMCSLVIZWNB-UHFFFAOYSA-N |
| Mol Weight | 239.27 g/mol |
| Molecular Formula | C8H5N3O2S2 |
| Exact Mass | 238.982319 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I1hcM5WyCCR |
|---|---|
| Name | 2-[2-Pyridylthio]-5-nitrothiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.982318759 u |
| Formula | C8H5N3O2S2 |
| InChI | InChI=1S/C8H5N3O2S2/c12-11(13)7-5-10-8(15-7)14-6-3-1-2-4-9-6/h1-5H |
| InChIKey | BCZPMCSLVIZWNB-UHFFFAOYSA-N |
| Molecular Weight | 239.267 g/mol |
| SMILES | C=1(N(=O)=O)SC(=NC1)SC=1N=CC=CC1 |