| SpectraBase Spectrum ID |
3KspA3r2Ff2 |
| Name |
2-Methyl-3-(3-phenylpropyl)benzo[d]thiazol-3-iumbromide |
| Appearance |
Pink solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.034333758 u |
| Formula |
C17H18BrNS |
| InChI |
InChI=1S/C17H18NS.BrH/c1-14-18(16-11-5-6-12-17(16)19-14)13-7-10-15-8-3-2-4-9-15;/h2-6,8-9,11-12H,7,10,13H2,1H3;1H/q+1;/p-1 |
| InChIKey |
BRBQXOGSKICITI-UHFFFAOYSA-M |
| Instrument Name |
Finnigan MAT TSQ 7000 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202202579 |
| Molecular Weight |
348.302 g/mol |
| Quality |
95 |
| SMILES |
C1=CC2=C(C=C1)[N+](=C(S2)C)CCCC1=CC=CC=C1.[Br-] |
| SPLASH |
splash10-03di-1920000000-1c1a0f5928adeb1e3717 |
| Source of Spectrum |
QE-28-SM41-2l (DOI: 10.1002/chem.202202579) |
| Thin-Layer Chromatography |
0.10 (n-hexane/acetone, 1:1) |
| Wiley ID |
1900739 |
![2-Methyl-3-(3-phenylpropyl)benzo[d]thiazol-3-iumbromide](/api/spectrum/3KspA3r2Ff2/structure.png?h=300&w=458 "2-Methyl-3-(3-phenylpropyl)benzo[d]thiazol-3-iumbromide")
