| SpectraBase Compound ID | 6K6fichu0BO |
|---|---|
| InChI | InChI=1S/C10H11N3OS/c1-2-7-13-8-5-3-4-6-9(8)15-10(13)11-12-14/h3-6H,2,7H2,1H3/b11-10- |
| InChIKey | JAFGQACPKHTHJJ-KHPPLWFESA-N |
| Mol Weight | 221.28 g/mol |
| Molecular Formula | C10H11N3OS |
| Exact Mass | 221.062283 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5WTtaS8FqKy |
|---|---|
| Name | (nz)-N-(3-Propyl-1,3-benzothiazol-2-ylidene)nitrous amide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.062283159 u |
| Formula | C10H11N3OS |
| InChI | InChI=1S/C10H11N3OS/c1-2-7-13-8-5-3-4-6-9(8)15-10(13)11-12-14/h3-6H,2,7H2,1H3/b11-10- |
| InChIKey | JAFGQACPKHTHJJ-KHPPLWFESA-N |
| Molecular Weight | 221.278 g/mol |
| SMILES | C=12N(\C(SC1C=CC=C2)=N\N=O)CCC |