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2-[5-AMINO-1-(2-CHLOROETHYL)-1H-IMIDAZOL-4-YLMETHYLENE]-MALONONITRILE
SpectraBase Compound ID Hmbv9LoLr8j
InChI InChI=1S/C9H8ClN5/c10-1-2-15-6-14-8(9(15)13)3-7(4-11)5-12/h3,6H,1-2,13H2
InChIKey UNGSTZHYVPSTFM-UHFFFAOYSA-N
Mol Weight 221.65 g/mol
Molecular Formula C9H8ClN5
Exact Mass 221.046823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9wS09XoNKB
Name 2-[[5-amino-1-(2-chloroethyl)-4-imidazolyl]methylidene]propanedinitrile
Alternate Name(s) 2-[[5-amino-1-(2-chloroethyl)imidazol-4-yl]methylene]malononitrile 2-[[5-amino-1-(2-chloroethyl)imidazol-4-yl]methylene]propanedinitrile 2-[[5-amino-1-(2-chloroethyl)imidazol-4-yl]methylidene]propanedinitrile 2-[[5-azanyl-1-(2-chloroethyl)imidazol-4-yl]methylidene]propanedinitrile
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Formula C9H8ClN5
InChI InChI=1S/C9H8ClN5/c10-1-2-15-6-14-8(9(15)13)3-7(4-11)5-12/h3,6H,1-2,13H2
InChIKey UNGSTZHYVPSTFM-UHFFFAOYSA-N
Molecular Weight 221.651 g/mol
SMILES Nc1c(nc[n]1CCCl)C=C(C#N)C#N
SPLASH splash10-05fr-1950000000-0cab70183c46650e3f20
Source of Spectrum AJ-41-704-11
Wiley ID 1567644