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2(3H)-Imino-3-(2-nitrobenzyl)benzothiazole hydrobromide
SpectraBase Compound ID KOLXaXg7klf
InChI InChI=1S/C14H11N3O2S/c15-14-16(12-7-3-4-8-13(12)20-14)9-10-5-1-2-6-11(10)17(18)19/h1-8,15H,9H2
InChIKey DXADVDNVSALBIU-UHFFFAOYSA-N
Mol Weight 285.32 g/mol
Molecular Formula C14H11N3O2S
Exact Mass 285.057198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZGm1ExmPi1
Name 2(3H)-Imino-3-(2-nitrobenzyl)benzothiazole hydrobromide
Alternate Name(s) 3-(2-Nitrobenzyl)-1,3-benzothiazol-2(3H)-imine 3-[(2-nitrophenyl)methyl]-1,3-benzothiazol-2-imine [3-(2-nitrobenzyl)-1,3-benzothiazol-2-ylidene]amine
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Formula C14H11N3O2S
InChI InChI=1S/C14H11N3O2S/c15-14-16(12-7-3-4-8-13(12)20-14)9-10-5-1-2-6-11(10)17(18)19/h1-8,15H,9H2
InChIKey DXADVDNVSALBIU-UHFFFAOYSA-N
Molecular Weight 285.321 g/mol
SMILES N=C1N(c2ccccc2S1)Cc1c(cccc1)N(=O)=O
SPLASH splash10-0udr-9410000000-b0cf8b9a93228081d737
Wiley ID 1467622