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3-benzyl-2-methylbenzothiazolium bromide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-benzyl-2-methylbenzothiazolium bromide
SpectraBase Compound ID CVn6kEFr5fJ
InChI InChI=1S/C15H14NS.BrH/c1-12-16(11-13-7-3-2-4-8-13)14-9-5-6-10-15(14)17-12;/h2-10H,11H2,1H3;1H/q+1;/p-1
InChIKey OJQNMYBWPLSWJX-UHFFFAOYSA-M
Mol Weight 320.25 g/mol
Molecular Formula C15H14BrNS
Exact Mass 319.003034 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KkoaQbNQroq
Name 3-BENZYL-2-METHYLBENZOTHIAZOLIUM BROMIDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S39469
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14BrNS
InChI InChI=1S/C15H14NS.BrH/c1-12-16(11-13-7-3-2-4-8-13)14-9-5-6-10-15(14)17-12;/h2-10H,11H2,1H3;1H/q+1;/p-1
InChIKey OJQNMYBWPLSWJX-UHFFFAOYSA-M
Molecular Weight 320.253998
Synonyms BENZOTHIAZOLIUM BROMIDE, 3-BENZYL- 2-METHYL-,
Technique KBr WAFER