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3-(4'-BrOMOPHENYL)-3-OXOPROPANENITRILE
SpectraBase Compound ID ABfEsSamkd7
InChI InChI=1S/C9H6BrNO/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4H,5H2
InChIKey HSNWUXWZCSDJPL-UHFFFAOYSA-N
Mol Weight 224.06 g/mol
Molecular Formula C9H6BrNO
Exact Mass 222.963277 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IJFxs7MLRJA
Name 3-(4-bromophenyl)-3-keto-propionitrile
Alternate Name(s) 3-(4-bromophenyl)-3-oxidanylidene-propanenitrile 3-(4-bromophenyl)-3-oxo-propanenitrile
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Formula C9H6BrNO
InChI InChI=1S/C9H6BrNO/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4H,5H2
InChIKey HSNWUXWZCSDJPL-UHFFFAOYSA-N
Molecular Weight 224.057 g/mol
SMILES C(#N)CC(c1ccc(cc1)Br)=O
SPLASH splash10-000i-1900000000-1f8fa95f8257d65ac230
Source of Spectrum OP-33-352-1
Wiley ID 851043