| SpectraBase Compound ID | 8Ly61kJtpIk |
|---|---|
| InChI | InChI=1S/C9H7N3O3S/c1-5(13)10-9-11-7-3-2-6(12(14)15)4-8(7)16-9/h2-4H,1H3,(H,10,11,13) |
| InChIKey | XARDSBCDZPSYTN-UHFFFAOYSA-N |
| Mol Weight | 237.23 g/mol |
| Molecular Formula | C9H7N3O3S |
| Exact Mass | 237.020812 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | RU5wpBm8Lz |
|---|---|
| Name | N-(6-Nitro-1,3-benzothiazol-2-yl)acetamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.020812268 u |
| Formula | C9H7N3O3S |
| InChI | InChI=1S/C9H7N3O3S/c1-5(13)10-9-11-7-3-2-6(12(14)15)4-8(7)16-9/h2-4H,1H3,(H,10,11,13) |
| InChIKey | XARDSBCDZPSYTN-UHFFFAOYSA-N |
| Molecular Weight | 237.233 g/mol |
| SMILES | C(C)(=O)NC=1SC2=CC(=CC=C2N1)N(=O)=O |