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N2,N2-Dimethyl-N1-[3-(p-bromobenzoylmethyl)benzothiazol-2-ylidene]amidinium bromide

View entire compound with spectra: 1 MS (GC)

N2,N2-Dimethyl-N1-[3-(p-bromobenzoylmethyl)benzothiazol-2-ylidene]amidinium bromide
SpectraBase Compound ID Gk3tgG7lknz
InChI InChI=1S/C18H17BrN3OS.BrH/c1-21(2)12-20-18-22(15-5-3-4-6-17(15)24-18)11-16(23)13-7-9-14(19)10-8-13;/h3-10,12H,11H2,1-2H3;1H/q+1;/p-1
InChIKey JINWGGILHNOBGT-UHFFFAOYSA-M
Mol Weight 483.22 g/mol
Molecular Formula C18H17Br2N3OS
Exact Mass 480.945909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID fmBQVn8HDU
Name N2,N2-Dimethyl-N1-[3-(p-bromobenzoylmethyl)benzothiazol-2-ylidene]amidinium bromide
Alternate Name(s) N-{[((2Z)-3-[2-(4-bromophenyl)-2-oxoethyl]-1,3-benzothiazol-2(3H)-ylidene)amino]methylene}-N-methylmethanaminium bromide [[3-[2-(4-bromophenyl)-2-keto-ethyl]-1,3-benzothiazol-2-ylidene]amino]methylene-dimethyl-ammonium bromide [[3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene-dimethyl-azanium bromide [[3-[2-(4-bromophenyl)-2-oxo-ethyl]-1,3-benzothiazol-2-ylidene]amino]methylene-dimethyl-ammonium bromide [[3-[2-(4-bromophenyl)-2-oxoethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene-dimethylammonium bromide [[3-[2-(4-bromophenyl)-2-oxoethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene-dimethylazanium bromide [[3-[2-(4-bromophenyl)-2-oxoethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene-dimethylammonium;bromide [[3-[2-(4-bromophenyl)-2-oxoethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene-dimethylazanium;bromide [[3-[2-(4-bromophenyl)-2-oxo-ethyl]-1,3-benzothiazol-2-ylidene]amino]methylene-dimethyl-ammonium;bromide [[3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-ylidene]amino]methylidene-dimethyl-azanium;bromide
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Formula C18H17Br2N3OS
InChI InChI=1S/C18H17BrN3OS.BrH/c1-21(2)12-20-18-22(15-5-3-4-6-17(15)24-18)11-16(23)13-7-9-14(19)10-8-13;/h3-10,12H,11H2,1-2H3;1H/q+1;/p-1
InChIKey JINWGGILHNOBGT-UHFFFAOYSA-M
Molecular Weight 483.222 g/mol
SMILES [Br-].c12N(\C(Sc1cccc2)=N\C=[N+](C)C)CC(c1ccc(Br)cc1)=O
SPLASH splash10-0kai-0906600000-8071e310400a2efad8c6
Source of Spectrum K-2002-743-5
Wiley ID 1581005