![2-{[(dimethylamino)methylene]amino}-5-methyl-3-(p-methylphenacyl)-1,3,4-thiadiazolium bromide](/api/spectrum/DJz5Senjgd7/structure.png?h=300&w=458 "2-{[(dimethylamino)methylene]amino}-5-methyl-3-(p-methylphenacyl)-1,3,4-thiadiazolium bromide")
| SpectraBase Compound ID | LEfE2eJeTo8 |
|---|---|
| InChI | InChI=1S/C15H19N4OS.BrH/c1-11-5-7-13(8-6-11)14(20)9-19-15(16-10-18(3)4)21-12(2)17-19;/h5-8,10H,9H2,1-4H3;1H/q+1;/p-1 |
| InChIKey | ZXYMEJDFBIFEAZ-UHFFFAOYSA-M |
| Mol Weight | 383.308 g/mol |
| Molecular Formula | C15H19BrN4OS |
| Exact Mass | 382.046295 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DJz5Senjgd7 |
|---|---|
| Name | 2-{[(dimethylamino)methylene]amino}-5-methyl-3-(p-methylphenacyl)-1,3,4-thiadiazolium bromide |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H20BrN3OS |
| InChI | InChI=1S/C15H19N4OS.BrH/c1-11-5-7-13(8-6-11)14(20)9-19-15(16-10-18(3)4)21-12(2)17-19;/h5-8,10H,9H2,1-4H3;1H/q+1;/p-1 |
| InChIKey | ZXYMEJDFBIFEAZ-UHFFFAOYSA-M |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 60976M |
| Solvent | CDCl3 |