| SpectraBase Compound ID | LUXQApsqQAJ |
|---|---|
| InChI | InChI=1S/C12H8F3NOS/c1-2-5-16-9-6-8(12(13,14)15)3-4-10(9)18-7-11(16)17/h1,3-4,6H,5,7H2 |
| InChIKey | JPSIDRIFPUGYAQ-UHFFFAOYSA-N |
| Mol Weight | 271.26 g/mol |
| Molecular Formula | C12H8F3NOS |
| Exact Mass | 271.02787 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HT0Hvn2w4Na |
|---|---|
| Name | 4-(2-propynyl)-6-(trifluoromethyl)-2H-1,4-benzothiazin-3(4H)-one |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H8F3NOS |
| InChI | InChI=1S/C12H8F3NOS/c1-2-5-16-9-6-8(12(13,14)15)3-4-10(9)18-7-11(16)17/h1,3-4,6H,5,7H2 |
| InChIKey | JPSIDRIFPUGYAQ-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 8981M |
| Sadtler Reference Number | 8981 |
| Solvent | CDCl3 |