| SpectraBase Compound ID | GkzPeQGAJhS |
|---|---|
| InChI | InChI=1S/C12H13NS/c1-9(2)12-13-11(8-14-12)10-6-4-3-5-7-10/h3-9H,1-2H3 |
| InChIKey | IIINACKGVRAZSE-UHFFFAOYSA-N |
| Mol Weight | 203.3 g/mol |
| Molecular Formula | C12H13NS |
| Exact Mass | 203.076871 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9Jiyy4nmnZy |
|---|---|
| Name | Thiazole, 2-(1-methylethyl)-4-phenyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 203.076870597 u |
| Formula | C12H13NS |
| InChI | InChI=1S/C12H13NS/c1-9(2)12-13-11(8-14-12)10-6-4-3-5-7-10/h3-9H,1-2H3 |
| InChIKey | IIINACKGVRAZSE-UHFFFAOYSA-N |
| Molecular Weight | 203.303 g/mol |
| SMILES | C(C)(C)C1=NC(C2=CC=CC=C2)=CS1 |