| SpectraBase Spectrum ID |
8QBb9ef32Mv |
| Name |
N-Benzoylisoquinolinium triflate |
| Alternate Name(s) |
2-Benzoylisoquinolinium trifluoromethanesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H12F3NO4S |
| InChI |
InChI=1S/C16H12NO.CHF3O3S/c18-16(14-7-2-1-3-8-14)17-11-10-13-6-4-5-9-15(13)12-17;2-1(3,4)8(5,6)7/h1-12H;(H,5,6,7)/q+1;/p-1 |
| InChIKey |
QJQRCLMITKKSBA-UHFFFAOYSA-M |
| Molecular Weight |
383.341 g/mol |
| SMILES |
C([n+]1cc2ccccc2cc1)(=O)c1ccccc1.C(S([O-])(=O)=O)(F)(F)F |
| SPLASH |
splash10-004i-2900000000-0dbedefe9ffcfa563ea8 |
| Source of Spectrum |
Y-28-1801-3 |
| Wiley ID |
1360987 |
