SpectraBase Spectrum ID |
4fIhNhpdmKO |
Name |
2-Methyl-3-(4-methylbenzyl)benzo[d]thiazol-3-iumbromide |
Appearance |
Colorless solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
333.018683693 u |
Formula |
C16H16BrNS |
InChI |
InChI=1S/C16H16NS.BrH/c1-12-7-9-14(10-8-12)11-17-13(2)18-16-6-4-3-5-15(16)17;/h3-10H,11H2,1-2H3;1H/q+1;/p-1 |
InChIKey |
DAGGQFXVPFMHOA-UHFFFAOYSA-M |
Instrument Name |
Finnigan MAT TSQ 7000 |
Ionization Type |
EI positive ion |
Literature Reference DOI |
10.1002/chem.202202579 |
Molecular Weight |
334.275 g/mol |
Quality |
102 |
SMILES |
[Br-].C1=CC2=C(C=C1)[N+](=C(S2)C)CC1=CC=C(C=C1)C |
SPLASH |
splash10-0pb9-2960000000-5c07475ea4a8db0abda2 |
Source of Spectrum |
QE-28-SM35-2f (DOI: 10.1002/chem.202202579) |
Thin-Layer Chromatography |
0.10 (n-hexane/acetone, 1:1) |
Wiley ID |
1900733 |