| SpectraBase Compound ID | 4BnTQxdnbP9 |
|---|---|
| InChI | InChI=1S/C15H11NOS/c1-10-6-2-3-7-11(10)14(17)15-16-12-8-4-5-9-13(12)18-15/h2-9H,1H3 |
| InChIKey | WCMFPOIPJJKJDK-UHFFFAOYSA-N |
| Mol Weight | 253.32 g/mol |
| Molecular Formula | C15H11NOS |
| Exact Mass | 253.056135 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | wUEKNIxvf5 |
|---|---|
| Name | 1,3-Benzothiazol-2-yl(2-methylphenyl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 253.056135151 u |
| Formula | C15H11NOS |
| InChI | InChI=1S/C15H11NOS/c1-10-6-2-3-7-11(10)14(17)15-16-12-8-4-5-9-13(12)18-15/h2-9H,1H3 |
| InChIKey | WCMFPOIPJJKJDK-UHFFFAOYSA-N |
| Molecular Weight | 253.319 g/mol |
| SMILES | C1(=NC2=CC=CC=C2S1)C(C=1C(C)=CC=CC1)=O |