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2-(5-Nitro-pyridin-2-ylsulfanyl)-benzothiazole

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2-(5-Nitro-pyridin-2-ylsulfanyl)-benzothiazole
SpectraBase Compound ID BLgqw8S2fNt
InChI InChI=1S/C12H7N3O2S2/c16-15(17)8-5-6-11(13-7-8)19-12-14-9-3-1-2-4-10(9)18-12/h1-7H
InChIKey PBCTUBOKJZTANL-UHFFFAOYSA-N
Mol Weight 289.33 g/mol
Molecular Formula C12H7N3O2S2
Exact Mass 288.997969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5rvOXXLHCFa
Name 2-(5-Nitro-pyridin-2-ylsulfanyl)-benzothiazole
Alternate Name(s) 2-(5-nitropyridin-2-yl)sulfanyl-1,3-benzothiazole 2-[(5-nitro-2-pyridinyl)thio]-1,3-benzothiazole 2-[(5-nitro-2-pyridyl)sulfanyl]-1,3-benzothiazole 2-[(5-nitro-2-pyridyl)thio]-1,3-benzothiazole
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Formula C12H7N3O2S2
InChI InChI=1S/C12H7N3O2S2/c16-15(17)8-5-6-11(13-7-8)19-12-14-9-3-1-2-4-10(9)18-12/h1-7H
InChIKey PBCTUBOKJZTANL-UHFFFAOYSA-N
Molecular Weight 289.327 g/mol
SMILES c1(nc2ccccc2s1)Sc1ncc(N(=O)=O)cc1
SPLASH splash10-000i-7980000000-c0bfdf5e66dc2f1c12f9
Wiley ID 1450482