| SpectraBase Compound ID | 8aGKj3nAVKu |
|---|---|
| InChI | InChI=1S/C11H9NO2S/c13-11(14)9-7-15-10(12-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14) |
| InChIKey | OUVVHURAIHESSK-UHFFFAOYSA-N |
| Mol Weight | 219.26 g/mol |
| Molecular Formula | C11H9NO2S |
| Exact Mass | 219.0354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6arNI4DJKV2 |
|---|---|
| Name | 2-Benzyl-1,3-thiazole-4-carboxylic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.035399706 u |
| Formula | C11H9NO2S |
| InChI | InChI=1S/C11H9NO2S/c13-11(14)9-7-15-10(12-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14) |
| InChIKey | OUVVHURAIHESSK-UHFFFAOYSA-N |
| Molecular Weight | 219.258 g/mol |
| SMILES | C=1(SC=C(N1)C(=O)O)CC1=CC=CC=C1 |