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4H-Chromone, 7-bromo-3-formyl-, 3-thiosemicarbazone
SpectraBase Compound ID 8kKo3WRc13a
InChI InChI=1S/C11H8BrN3O2S/c12-7-1-2-8-9(3-7)17-5-6(10(8)16)4-14-15-11(13)18/h1-5H,(H3,13,15,18)/b14-4+
InChIKey CALQRYXLEKULSN-LNKIKWGQSA-N
Mol Weight 326.17 g/mol
Molecular Formula C11H8BrN3O2S
Exact Mass 324.952061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hhnRnXBUe
Name 4H-Chromone, 7-bromo-3-formyl-, 3-thiosemicarbazone
Alternate Name(s) 1-[(E)-(7-bromanyl-4-oxidanylidene-chromen-3-yl)methylideneamino]thiourea 7-Bromo-4-oxo-4H-chromene-3-carbaldehyde thiosemicarbazone [(E)-(7-bromo-4-keto-chromen-3-yl)methyleneamino]thiourea [(E)-(7-bromo-4-oxo-1-benzopyran-3-yl)methylideneamino]thiourea [(E)-(7-bromo-4-oxo-chromen-3-yl)methyleneamino]thiourea [(E)-(7-bromo-4-oxochromen-3-yl)methylideneamino]thiourea
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Formula C11H8BrN3O2S
InChI InChI=1S/C11H8BrN3O2S/c12-7-1-2-8-9(3-7)17-5-6(10(8)16)4-14-15-11(13)18/h1-5H,(H3,13,15,18)/b14-4+
InChIKey CALQRYXLEKULSN-LNKIKWGQSA-N
Molecular Weight 326.168 g/mol
SMILES N(\N=C\C1=COc2cc(ccc2C1=O)Br)C(N)=S
SPLASH splash10-0ufr-9351000000-58aae0bd03bc087f5d0e
Source of Spectrum AD-0-2532-0
Wiley ID 1424220