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1-(Cyclohexylamino)-3-(morpholin-4-yl)-2-phenyl-2H-imidazo[5,1-a]isoquinolinium Chloride
SpectraBase Compound ID 1HhsWS9eTCH
InChI InChI=1S/C27H31N4O.ClH/c1-3-10-22(11-4-1)28-26-25-24-14-8-7-9-21(24)15-16-30(25)27(29-17-19-32-20-18-29)31(26)23-12-5-2-6-13-23;/h2,5-9,12-16,22,28H,1,3-4,10-11,17-20H2;1H/q+1;/p-1
InChIKey RFAASRLHFFQECJ-UHFFFAOYSA-M
Mol Weight 463.03 g/mol
Molecular Formula C27H31ClN4O
Exact Mass 462.218639 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICAtmLMpbaC
Name 1-(Cyclohexylamino)-3-(morpholin-4-yl)-2-phenyl-2H-imidazo[5,1-a]isoquinolinium Chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H31ClN4O
InChI InChI=1S/C27H31N4O.ClH/c1-3-10-22(11-4-1)28-26-25-24-14-8-7-9-21(24)15-16-30(25)27(29-17-19-32-20-18-29)31(26)23-12-5-2-6-13-23;/h2,5-9,12-16,22,28H,1,3-4,10-11,17-20H2;1H/q+1;/p-1
InChIKey RFAASRLHFFQECJ-UHFFFAOYSA-M
Literature Reference DOI 10.1002/hlca.200900216
Molecular Weight 463.025 g/mol
SMILES N(c1[n](c([n+]2c1c1ccccc1cc2)N1CCOCC1)-c1ccccc1)C1CCCCC1.[Cl-]
SPLASH splash10-054x-9837000000-26a41f22447daaf1c02f
Source of Spectrum H-93-74-4b
Synonyms 1-(cyclohexylamino)-3-morpholino-2-phenyl-2H-imidazo[5,1-a]isoquinolin-4-ium chloride
Wiley ID 1785780