| SpectraBase Compound ID | 54oy0XCjzht |
|---|---|
| InChI | InChI=1S/C10H10N2O2S2/c11-6(9(13)14)5-15-10-12-7-3-1-2-4-8(7)16-10/h1-4,6H,5,11H2,(H,13,14) |
| InChIKey | KRBPTLCTECPKGY-UHFFFAOYSA-N |
| Mol Weight | 254.32 g/mol |
| Molecular Formula | C10H10N2O2S2 |
| Exact Mass | 254.01837 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IYcNLKjEKLK |
|---|---|
| Name | S-(2-Benzothiazolyl)cysteine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.018369916 u |
| Formula | C10H10N2O2S2 |
| InChI | InChI=1S/C10H10N2O2S2/c11-6(9(13)14)5-15-10-12-7-3-1-2-4-8(7)16-10/h1-4,6H,5,11H2,(H,13,14) |
| InChIKey | KRBPTLCTECPKGY-UHFFFAOYSA-N |
| Molecular Weight | 254.322 g/mol |
| SMILES | C12=C(C=CC=C2)SC(=N1)SCC(N)C(O)=O |