For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-(4-Bromobutyl)-2-methylbenzo[d]thiazol-3-iumbromide
SpectraBase Compound ID 2l53sequlWh
InChI InChI=1S/C12H15BrNS.BrH/c1-10-14(9-5-4-8-13)11-6-2-3-7-12(11)15-10;/h2-3,6-7H,4-5,8-9H2,1H3;1H/q+1;/p-1
InChIKey KWYQPIWHDJDBFR-UHFFFAOYSA-M
Mol Weight 365.13 g/mol
Molecular Formula C12H15Br2NS
Exact Mass 362.929197 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID I1Se5QuyGLb
Name 3-(4-Bromobutyl)-2-methylbenzo[d]thiazol-3-iumbromide
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.929196661 u
Formula C12H15Br2NS
InChI InChI=1S/C12H15BrNS.BrH/c1-10-14(9-5-4-8-13)11-6-2-3-7-12(11)15-10;/h2-3,6-7H,4-5,8-9H2,1H3;1H/q+1;/p-1
InChIKey KWYQPIWHDJDBFR-UHFFFAOYSA-M
Instrument Name Finnigan MAT TSQ 7000
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.202202579
Quality 193
SMILES [Br-].C1=CC2=C(C=C1)[N+](=C(S2)C)CCCCBr
SPLASH splash10-0f6t-0940000000-1a6909555768680f48ab
Source of Spectrum QE-28-SM31-2b (DOI: 10.1002/chem.202202579)
Thin-Layer Chromatography 0.10 (n-hexane/acetone, 1:1)
Wiley ID 1900729