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2-Pyridinamine, N-[2-bromo-4-(1-methylethyl)phenyl]-5-[6-(1H-imidazol-1-yl)hexyl]-
SpectraBase Compound ID JJRk8OW0jxN
InChI InChI=1S/C23H29BrN4/c1-18(2)20-9-10-22(21(24)15-20)27-23-11-8-19(16-26-23)7-5-3-4-6-13-28-14-12-25-17-28/h8-12,14-18H,3-7,13H2,1-2H3,(H,26,27)
InChIKey WYLHJTATJHVZQA-UHFFFAOYSA-N
Mol Weight 441.42 g/mol
Molecular Formula C23H29BrN4
Exact Mass 440.15756 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOzpTo6tJTI
Name 2-Pyridinamine, N-[2-bromo-4-(1-methylethyl)phenyl]-5-[6-(1H-imidazol-1-yl)hexyl]-
CAS Registry Number 107962-20-9
Comments Less than 3 mono-isotopic peaks
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Formula C23H29BrN4
InChI InChI=1S/C23H29BrN4/c1-18(2)20-9-10-22(21(24)15-20)27-23-11-8-19(16-26-23)7-5-3-4-6-13-28-14-12-25-17-28/h8-12,14-18H,3-7,13H2,1-2H3,(H,26,27)
InChIKey WYLHJTATJHVZQA-UHFFFAOYSA-N
Molecular Weight 441.417 g/mol
SMILES N(c1ccc(cn1)CCCCCC[n]1cncc1)c1c(cc(cc1)C(C)C)Br
SPLASH splash10-0006-0000900000-ecd3516ba0d70818de94
Source of Spectrum J-52-2474-25
Synonyms 2-[[2-bromo-4-(1-methylethyl)phenyl]amino]-5-[6-(1H-imidazol-1-yl)hexyl]pyridine N-(2-bromo-4-isopropylphenyl)-5-[6-(1H-imidazol-1-yl)hexyl]-2-pyridinamine N-(2-bromo-4-isopropylphenyl)-N-{5-[6-(1H-imidazol-1-yl)hexyl]-2-pyridinyl}amine
Wiley ID 1384629