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5,6,8-tribromo-7-oxo-N-(phenylmethyl)-2,3-dihydroquinoxaline-1-carbothioamide
SpectraBase Compound ID 4HiBS9LlYxH
InChI InChI=1S/C16H12Br3N3OS/c17-10-11(18)15(23)12(19)14-13(10)20-6-7-22(14)16(24)21-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,21,24)
InChIKey LITPCHVQDKZDHB-UHFFFAOYSA-N
Mol Weight 534.06 g/mol
Molecular Formula C16H12Br3N3OS
Exact Mass 530.825122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0seTJQs9XE
Name 5,6,8-tribromo-7-oxo-N-(phenylmethyl)-2,3-dihydroquinoxaline-1-carbothioamide
Alternate Name(s) 5,6,8-tris(bromanyl)-7-oxidanylidene-N-(phenylmethyl)-2,3-dihydroquinoxaline-1-carbothioamide N-benzyl-5,6,8-tribromo-7-keto-2,3-dihydroquinoxaline-1-carbothioamide N-benzyl-5,6,8-tribromo-7-oxo-2,3-dihydroquinoxaline-1-carbothioamide
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Formula C16H12Br3N3OS
InChI InChI=1S/C16H12Br3N3OS/c17-10-11(18)15(23)12(19)14-13(10)20-6-7-22(14)16(24)21-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,21,24)
InChIKey LITPCHVQDKZDHB-UHFFFAOYSA-N
Molecular Weight 534.064 g/mol
SMILES N(C(N1CCN=C2C(=C(C(C(=C12)Br)=O)Br)Br)=S)Cc1ccccc1
SPLASH splash10-0006-9101270000-a875baeff224d6f76fbb
Source of Spectrum AJ-43-474-15
Wiley ID 1593997