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4-Methyl-1H-benzimidazole-1-(3-methyl)propanenitrile
SpectraBase Compound ID 3JMDWknOyAq
InChI InChI=1S/C12H13N3/c1-9-4-3-5-11-12(9)14-8-15(11)10(2)6-7-13/h3-5,8,10H,6H2,1-2H3
InChIKey KMJSDWIBDOJONE-UHFFFAOYSA-N
Mol Weight 199.26 g/mol
Molecular Formula C12H13N3
Exact Mass 199.110947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EfhiPqa1JXZ
Name 4-Methyl-1H-benzimidazole-1-(3-methyl)propanenitrile
Alternate Name(s) 3-(4-Methyl-1-benzimidazolyl)butanenitrile 3-(4-Methylbenzimidazol-1-yl)butanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N3
InChI InChI=1S/C12H13N3/c1-9-4-3-5-11-12(9)14-8-15(11)10(2)6-7-13/h3-5,8,10H,6H2,1-2H3
InChIKey KMJSDWIBDOJONE-UHFFFAOYSA-N
Molecular Weight 199.257 g/mol
SMILES c1[n](c2c(n1)c(ccc2)C)C(CC#N)C
SPLASH splash10-0a4i-1900000000-cf84763c4d42e8599bf6
Source of Spectrum SO-0-1187-5
Wiley ID 1545937