![1,3-Benzothiazol-2-yl[4-(trifluoromethyl)phenyl]methanone](/api/spectrum/FbeP41k0c6f/structure.png?h=300&w=458 "1,3-Benzothiazol-2-yl[4-(trifluoromethyl)phenyl]methanone")
| SpectraBase Compound ID | KBdZE0qSO32 |
|---|---|
| InChI | InChI=1S/C15H8F3NOS/c16-15(17,18)10-7-5-9(6-8-10)13(20)14-19-11-3-1-2-4-12(11)21-14/h1-8H |
| InChIKey | PQIOIJFONDQCGQ-UHFFFAOYSA-N |
| Mol Weight | 307.29 g/mol |
| Molecular Formula | C15H8F3NOS |
| Exact Mass | 307.02787 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FbeP41k0c6f |
|---|---|
| Name | 1,3-Benzothiazol-2-yl[4-(trifluoromethyl)phenyl]methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.027869544 u |
| Formula | C15H8F3NOS |
| InChI | InChI=1S/C15H8F3NOS/c16-15(17,18)10-7-5-9(6-8-10)13(20)14-19-11-3-1-2-4-12(11)21-14/h1-8H |
| InChIKey | PQIOIJFONDQCGQ-UHFFFAOYSA-N |
| Molecular Weight | 307.290 g/mol |
| SMILES | C(=O)(C=1C=CC(=CC1)C(F)(F)F)C=1SC=2C(N1)=CC=CC2 |