![2-Phenyl-4-[(phenylsulfonyl)methyl]thiazole](/api/spectrum/9f7qrDVPPQw/structure.png?h=300&w=458 "2-Phenyl-4-[(phenylsulfonyl)methyl]thiazole")
| SpectraBase Compound ID | Fl4JpTXu1vk |
|---|---|
| InChI | InChI=1S/C16H13NO2S2/c18-21(19,15-9-5-2-6-10-15)12-14-11-20-16(17-14)13-7-3-1-4-8-13/h1-11H,12H2 |
| InChIKey | QIIGEWLPTNCKDE-UHFFFAOYSA-N |
| Mol Weight | 315.41 g/mol |
| Molecular Formula | C16H13NO2S2 |
| Exact Mass | 315.038771 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9f7qrDVPPQw |
|---|---|
| Name | 2-Phenyl-4-[(phenylsulfonyl)methyl]thiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 315.038771009 u |
| Formula | C16H13NO2S2 |
| InChI | InChI=1S/C16H13NO2S2/c18-21(19,15-9-5-2-6-10-15)12-14-11-20-16(17-14)13-7-3-1-4-8-13/h1-11H,12H2 |
| InChIKey | QIIGEWLPTNCKDE-UHFFFAOYSA-N |
| Molecular Weight | 315.405 g/mol |
| SMILES | C(S(=O)(=O)C1=CC=CC=C1)C=1N=C(C=2C=CC=CC2)SC1 |