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1-(Cyclohexylamino)-3-(dimethylamino)-2-phenyl-2H-imidazo[5,1-a]isoquinolinium Chloride
SpectraBase Compound ID LMkInk5fqNa
InChI InChI=1S/C25H29N4.ClH/c1-27(2)25-28-18-17-19-11-9-10-16-22(19)23(28)24(26-20-12-5-3-6-13-20)29(25)21-14-7-4-8-15-21;/h4,7-11,14-18,20,26H,3,5-6,12-13H2,1-2H3;1H/q+1;/p-1
InChIKey LLTDKICRKZIZQI-UHFFFAOYSA-M
Mol Weight 420.99 g/mol
Molecular Formula C25H29ClN4
Exact Mass 420.208075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDVnfvCP4Bs
Name 1-(Cyclohexylamino)-3-(dimethylamino)-2-phenyl-2H-imidazo[5,1-a]isoquinolinium Chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29ClN4
InChI InChI=1S/C25H29N4.ClH/c1-27(2)25-28-18-17-19-11-9-10-16-22(19)23(28)24(26-20-12-5-3-6-13-20)29(25)21-14-7-4-8-15-21;/h4,7-11,14-18,20,26H,3,5-6,12-13H2,1-2H3;1H/q+1;/p-1
InChIKey LLTDKICRKZIZQI-UHFFFAOYSA-M
Literature Reference DOI 10.1002/hlca.200900216
Molecular Weight 420.988 g/mol
SMILES N(c1[n](c([n+]2c1c1ccccc1cc2)N(C)C)-c1ccccc1)C1CCCCC1.[Cl-]
SPLASH splash10-0zic-7905000000-048ee51613eacc1ef976
Source of Spectrum H-93-75-4d
Synonyms 1-(cyclohexylamino)-3-(dimethylamino)-2-phenyl-2H-imidazo[5,1-a]isoquinolin-4-ium chloride
Wiley ID 1785782