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1H-Imidazole-2-propanenitrile, 1-methyl-.alpha.,.alpha.-bis[(1-methyl-1H-imidazol-2-yl)methyl]-
SpectraBase Compound ID 6GAb30C4bIi
InChI InChI=1S/C17H21N7/c1-22-7-4-19-14(22)10-17(13-18,11-15-20-5-8-23(15)2)12-16-21-6-9-24(16)3/h4-9H,10-12H2,1-3H3
InChIKey YIGPFJBQMRWOHF-UHFFFAOYSA-N
Mol Weight 323.4 g/mol
Molecular Formula C17H21N7
Exact Mass 323.185844 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhAVOX4iTIr
Name 1H-Imidazole-2-propanenitrile, 1-methyl-.alpha.,.alpha.-bis[(1-methyl-1H-imidazol-2-yl)methyl]-
CAS Registry Number 119336-43-5
Comments Less than 3 mono-isotopic peaks
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Formula C17H21N7
InChI InChI=1S/C17H21N7/c1-22-7-4-19-14(22)10-17(13-18,11-15-20-5-8-23(15)2)12-16-21-6-9-24(16)3/h4-9H,10-12H2,1-3H3
InChIKey YIGPFJBQMRWOHF-UHFFFAOYSA-N
Molecular Weight 323.404 g/mol
SMILES c1([n](ccn1)C)CC(C#N)(Cc1[n](ccn1)C)Cc1[n](ccn1)C
SPLASH splash10-004i-0090000000-6be59b24b2ad38a78f7e
Source of Spectrum J-54-1441-17
Synonyms 3-(1-methyl-1H-imidazol-2-yl)-2,2-bis[(1-methyl-1H-imidazol-2-yl)methyl]propanenitrile Tris[(1-methyl-2-imidazolyl)methyl]acetonitrile
Wiley ID 1322401