![1-[[3-(2-chloro-6-fluorophneyl)-5-methyl-4-isoxazolyl]carbonyl}-2-(methylthio)-1,4,5,6-tetrahydropyrimidine](/api/spectrum/JNaHujbJVZU/structure.png?h=300&w=458 "1-[[3-(2-chloro-6-fluorophneyl)-5-methyl-4-isoxazolyl]carbonyl}-2-(methylthio)-1,4,5,6-tetrahydropyrimidine")
| SpectraBase Compound ID | Cx5NwjXDc0L |
|---|---|
| InChI | InChI=1S/C16H15ClFN3O2S/c1-9-12(15(22)21-8-4-7-19-16(21)24-2)14(20-23-9)13-10(17)5-3-6-11(13)18/h3,5-6H,4,7-8H2,1-2H3 |
| InChIKey | MLTKNIXNGNNUDX-UHFFFAOYSA-N |
| Mol Weight | 367.83 g/mol |
| Molecular Formula | C16H15ClFN3O2S |
| Exact Mass | 367.055754 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JNaHujbJVZU |
|---|---|
| Name | 1-[[3-(2-chloro-6-fluorophneyl)-5-methyl-4-isoxazolyl]carbonyl}-2-(methylthio)-1,4,5,6-tetrahydropyrimidine |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H15ClFN3O2S |
| InChI | InChI=1S/C16H15ClFN3O2S/c1-9-12(15(22)21-8-4-7-19-16(21)24-2)14(20-23-9)13-10(17)5-3-6-11(13)18/h3,5-6H,4,7-8H2,1-2H3 |
| InChIKey | MLTKNIXNGNNUDX-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 46538M |
| Solvent | CDCl3 |