| SpectraBase Spectrum ID |
DytSEIy5JyX |
| Name |
1-(5-methyl-1-phenyl-pyrazol-4-yl)-2-pyridin-1-ium-1-yl-ethanone bromide |
| Appearance |
Brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H16BrN3O |
| InChI |
InChI=1S/C17H16N3O.BrH/c1-14-16(17(21)13-19-10-6-3-7-11-19)12-18-20(14)15-8-4-2-5-9-15;/h2-12H,13H2,1H3;1H/q+1;/p-1 |
| InChIKey |
IYPPPXLXZJUDRH-UHFFFAOYSA-M |
| Instrument Name |
Shimadzu GCMS-QP1000 EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2790 |
| Molecular Weight |
358.239 g/mol |
| SMILES |
c1[n+](cccc1)CC(c1c([n](nc1)-c1ccccc1)C)=O.[Br-] |
| SPLASH |
splash10-0a59-9735000000-a298ddec942b2864eadc |
| Source of Spectrum |
Y-54-1946-2 |
| Wiley ID |
1878364 |
