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N2,N2-Dimethyl-N1-[3-(p-methylbenzoylmethyl)benzothiazol-2-ylidene]amidinium bromide
SpectraBase Compound ID 4ClxRKv6OJA
InChI InChI=1S/C19H20N3OS.BrH/c1-14-8-10-15(11-9-14)17(23)12-22-16-6-4-5-7-18(16)24-19(22)20-13-21(2)3;/h4-11,13H,12H2,1-3H3;1H/q+1;/p-1
InChIKey HTURDMDLFNPUIX-UHFFFAOYSA-M
Mol Weight 418.35 g/mol
Molecular Formula C19H20BrN3OS
Exact Mass 417.051046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmyJ2LWAWLF
Name N2,N2-Dimethyl-N1-[3-(p-methylbenzoylmethyl)benzothiazol-2-ylidene]amidinium bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20BrN3OS
InChI InChI=1S/C19H20N3OS.BrH/c1-14-8-10-15(11-9-14)17(23)12-22-16-6-4-5-7-18(16)24-19(22)20-13-21(2)3;/h4-11,13H,12H2,1-3H3;1H/q+1;/p-1
InChIKey HTURDMDLFNPUIX-UHFFFAOYSA-M
Molecular Weight 418.353 g/mol
SMILES [Br-].c12N(\C(Sc1cccc2)=N\C=[N+](C)C)CC(c1ccc(C)cc1)=O
SPLASH splash10-0007-5792000000-f54b27db7de416fddeaa
Source of Spectrum K-2002-743-5
Synonyms N-methyl-N-{[((2Z)-3-[2-(4-methylphenyl)-2-oxoethyl]-1,3-benzothiazol-2(3H)-ylidene)amino]methylene}methanaminium bromide Dimethyl-[[[3-[2-(4-methylphenyl)-2-oxoethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene]ammonium;bromide Dimethyl-[[[3-[2-(4-methylphenyl)-2-oxoethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene]azanium;bromide Dimethyl-[[[3-[2-oxo-2-(p-tolyl)ethyl]-1,3-benzothiazol-2-ylidene]amino]methylene]ammonium;bromide Dimethyl-[[[3-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene]azanium;bromide
Wiley ID 1581003