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2(3H)-imino-3-(3-nitrobenzoylmethyl)benzothiazole hydrobromide
SpectraBase Compound ID HXMZn8ZLLvQ
InChI InChI=1S/C15H11N3O3S.Br/c16-15-17(12-6-1-2-7-14(12)22-15)9-13(19)10-4-3-5-11(8-10)18(20)21;/h1-8,16H,9H2;
InChIKey HYXKXBMYFCJYDO-UHFFFAOYSA-N
Mol Weight 393.24 g/mol
Molecular Formula C15H11BrN3O3S
Exact Mass 391.97045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2i24Jky7r5N
Name 2(3H)-imino-3-(3-nitrobenzoylmethyl)benzothiazole hydrobromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12BrN3O3S
InChI InChI=1S/C15H11N3O3S.Br/c16-15-17(12-6-1-2-7-14(12)22-15)9-13(19)10-4-3-5-11(8-10)18(20)21;/h1-8,16H,9H2;
InChIKey HYXKXBMYFCJYDO-UHFFFAOYSA-N
Molecular Weight 394.243 g/mol
SMILES Br.N=C1N(c2ccccc2S1)CC(c1cc(ccc1)N(=O)=O)=O
SPLASH splash10-000x-9300000000-ac19a11975f50a2c77cc
Synonyms 2-(2-Imino-1,3-benzothiazol-3(2H)-yl)-1-(3-nitrophenyl)ethanone hydrobromide 2-(2-azanylidene-1,3-benzothiazol-3-yl)-1-(3-nitrophenyl)ethanone;hydrobromide
Wiley ID 1467257