| SpectraBase Spectrum ID |
GBzfwQk02g9 |
| Name |
2-Methyl-3-(4-(trifluoromethyl)benzyl)benzo[d]thiazol-3-iumbromide |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.990418086 u |
| Formula |
C16H13BrF3NS |
| InChI |
InChI=1S/C16H13F3NS.BrH/c1-11-20(14-4-2-3-5-15(14)21-11)10-12-6-8-13(9-7-12)16(17,18)19;/h2-9H,10H2,1H3;1H/q+1;/p-1 |
| InChIKey |
HEOCAUJFIDSQFT-UHFFFAOYSA-M |
| Instrument Name |
Finnigan MAT TSQ 7000 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202202579 |
| Molecular Weight |
388.246 g/mol |
| Quality |
129 |
| SMILES |
C1=CC2=C(C=C1)[N+](=C(S2)C)CC1=CC=C(C=C1)C(F)(F)F.[Br-] |
| SPLASH |
splash10-0a4j-0907000000-ae4575361d3f47937a14 |
| Source of Spectrum |
QE-28-SM48-2s (DOI: 10.1002/chem.202202579) |
| Thin-Layer Chromatography |
0.10 (n-hexane/acetone, 1:1) |
| Wiley ID |
1900746 |
![2-Methyl-3-(4-(trifluoromethyl)benzyl)benzo[d]thiazol-3-iumbromide](/api/spectrum/GBzfwQk02g9/structure.png?h=300&w=458 "2-Methyl-3-(4-(trifluoromethyl)benzyl)benzo[d]thiazol-3-iumbromide")
