| SpectraBase Spectrum ID |
FzqVK41cnCB |
| Name |
3-([1,1'-Biphenyl]-4-ylmethyl)-2-methylbenzo[d]thiazol-3-iumbromide |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
395.034333758 u |
| Formula |
C21H18BrNS |
| InChI |
InChI=1S/C21H18NS.BrH/c1-16-22(20-9-5-6-10-21(20)23-16)15-17-11-13-19(14-12-17)18-7-3-2-4-8-18;/h2-14H,15H2,1H3;1H/q+1;/p-1 |
| InChIKey |
HKXYYXZUZMPFBR-UHFFFAOYSA-M |
| Instrument Name |
Finnigan MAT TSQ 7000 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.202202579 |
| Molecular Weight |
396.346 g/mol |
| Quality |
17 |
| SMILES |
C1=CC2=C(C=C1)[N+](=C(S2)C)CC1=CC=C(C=C1)C1=CC=CC=C1.[Br-] |
| SPLASH |
splash10-014i-0900000000-3de71eaa465b75e7cb21 |
| Source of Spectrum |
QE-28-SM38-2i (DOI: 10.1002/chem.202202579) |
| Thin-Layer Chromatography |
0.10 (n-hexane/acetone, 1:1) |
| Wiley ID |
1900736 |
![3-([1,1'-Biphenyl]-4-ylmethyl)-2-methylbenzo[d]thiazol-3-iumbromide](/api/spectrum/FzqVK41cnCB/structure.png?h=300&w=458 "3-([1,1'-Biphenyl]-4-ylmethyl)-2-methylbenzo[d]thiazol-3-iumbromide")
