| SpectraBase Compound ID | Hqa84bJYNin |
|---|---|
| InChI | InChI=1S/C9H6N2O2S/c12-11(13)8-3-1-7(2-4-8)9-5-10-6-14-9/h1-6H |
| InChIKey | TYGQSXYFFFQKHH-UHFFFAOYSA-N |
| Mol Weight | 206.22 g/mol |
| Molecular Formula | C9H6N2O2S |
| Exact Mass | 206.014999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Cg1bsBjZoYV |
|---|---|
| Name | 5-(4-Nitrophenyl)thiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.014998613 u |
| Formula | C9H6N2O2S |
| InChI | InChI=1S/C9H6N2O2S/c12-11(13)8-3-1-7(2-4-8)9-5-10-6-14-9/h1-6H |
| InChIKey | TYGQSXYFFFQKHH-UHFFFAOYSA-N |
| Molecular Weight | 206.219 g/mol |
| SMILES | C=1(N(=O)=O)C=CC(C=2SC=NC2)=CC1 |