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4-[2-(2-Bromoethylimino)hydrazino]benzonitrile
SpectraBase Compound ID DxWNND6wXr7
InChI InChI=1S/C9H9BrN4/c10-5-6-12-14-13-9-3-1-8(7-11)2-4-9/h1-4H,5-6H2,(H,12,13)
InChIKey KWEHPAHJWZIAMS-UHFFFAOYSA-N
Mol Weight 253.1 g/mol
Molecular Formula C9H9BrN4
Exact Mass 252.001059 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHFD4HuXS2P
Name 4-[2-(2-Bromoethylimino)hydrazino]benzonitrile
Alternate Name(s) 4-[2-(2-Bromoethylimino)hydrazinyl]benzenecarbonitrile 4-[2-(2-Bromoethylimino)hydrazinyl]benzonitrile 4-[N'-(2-bromoethylimino)hydrazino]benzonitrile
CAS Registry Number 78604-20-3
Comments Less than 3 mono-isotopic peaks
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Formula C9H9BrN4
InChI InChI=1S/C9H9BrN4/c10-5-6-12-14-13-9-3-1-8(7-11)2-4-9/h1-4H,5-6H2,(H,12,13)
InChIKey KWEHPAHJWZIAMS-UHFFFAOYSA-N
Molecular Weight 253.103 g/mol
SMILES N(CCBr)\N=N\c1ccc(C#N)cc1
SPLASH splash10-004i-0190000000-c415e95acb754f4f28c0
Source of Spectrum I-59-1354-0
Wiley ID 1254960