![[4-(5-bromo-6-hydroxy-3,4-xylyl)-1,3-dithiol-2-ylidene]dimethylammonium chloride](/api/spectrum/6eIKkF06w3I/structure.png?h=300&w=458 "[4-(5-bromo-6-hydroxy-3,4-xylyl)-1,3-dithiol-2-ylidene]dimethylammonium chloride")
| SpectraBase Compound ID | Es0LqMcPHCZ |
|---|---|
| InChI | InChI=1S/C13H14BrNOS2.ClH/c1-7-5-9(12(16)11(14)8(7)2)10-6-17-13(18-10)15(3)4;/h5-6H,1-4H3;1H |
| InChIKey | BWXTUEOXVSSPIN-UHFFFAOYSA-N |
| Mol Weight | 380.75 g/mol |
| Molecular Formula | C13H15BrClNOS2 |
| Exact Mass | 378.946697 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6eIKkF06w3I |
|---|---|
| Name | [4-(5-bromo-6-hydroxy-3,4-xylyl)-1,3-dithiol-2-ylidene]dimethylammonium chloride |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H15BrClNOS2 |
| InChI | InChI=1S/C13H14BrNOS2.ClH/c1-7-5-9(12(16)11(14)8(7)2)10-6-17-13(18-10)15(3)4;/h5-6H,1-4H3;1H |
| InChIKey | BWXTUEOXVSSPIN-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 61364M |
| Solvent | DMSO-d6 |