| SpectraBase Compound ID | AHrHrHpgVQ |
|---|---|
| InChI | InChI=1S/C10H9BrNO.CHF3O3S/c1-13-12-6-8-4-2-3-5-9(8)10(11)7-12;2-1(3,4)8(5,6)7/h2-7H,1H3;(H,5,6,7)/q+1;/p-1 |
| InChIKey | FHHWJUUQYHIPHH-UHFFFAOYSA-M |
| Mol Weight | 388.16 g/mol |
| Molecular Formula | C11H9BrF3NO4S |
| Exact Mass | 386.938776 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JTWU365oJsO |
|---|---|
| Name | 4-BROMO-N-METHOXY-ISOQUINOLINIUM TRIFLUOROMETHANESULPHONATE |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C10H9BrNO.CHF3O3S/c1-13-12-6-8-4-2-3-5-9(8)10(11)7-12;2-1(3,4)8(5,6)7/h2-7H,1H3;(H,5,6,7)/q+1;/p-1 |
| InChIKey | FHHWJUUQYHIPHH-UHFFFAOYSA-M |
| Literature Reference | W.WERRA,D.HEBER,U.HOLZGRABE MAGN.RES.CHEM.,30,640(1992) |
| Solvent | Dimethyl sulfoxide-d6 |