![2-(cyclopropylcarbonyl)-3-{[4-(dimethylamino)-6-(methylthio)-s-triazin-2-yl]amino}acrylonitrile](/api/spectrum/GCHWa8LnZwa/structure.png?h=300&w=458 "2-(cyclopropylcarbonyl)-3-{[4-(dimethylamino)-6-(methylthio)-s-triazin-2-yl]amino}acrylonitrile")
| SpectraBase Compound ID | 4fJeN1PNwc2 |
|---|---|
| InChI | InChI=1S/C13H16N6OS/c1-19(2)12-16-11(17-13(18-12)21-3)15-7-9(6-14)10(20)8-4-5-8/h7-8H,4-5H2,1-3H3,(H,15,16,17,18) |
| InChIKey | SIZXZJBIWRCLBQ-UHFFFAOYSA-N |
| Mol Weight | 304.37 g/mol |
| Molecular Formula | C13H16N6OS |
| Exact Mass | 304.11063 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GCHWa8LnZwa |
|---|---|
| Name | 2-(cyclopropylcarbonyl)-3-{[4-(dimethylamino)-6-(methylthio)-s-triazin-2-yl]amino}acrylonitrile |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16N6OS |
| InChI | InChI=1S/C13H16N6OS/c1-19(2)12-16-11(17-13(18-12)21-3)15-7-9(6-14)10(20)8-4-5-8/h7-8H,4-5H2,1-3H3,(H,15,16,17,18) |
| InChIKey | SIZXZJBIWRCLBQ-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 48590M |
| Solvent | CDCl3 |