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1-[(tert-Butyl)amino]-3-(morpholin-4-yl)-2-phenyl-2H-imidazo[5,1-a]isoquinolinium Chloride
SpectraBase Compound ID JRCjk1pX25D
InChI InChI=1S/C25H29N4O.ClH/c1-25(2,3)26-23-22-21-12-8-7-9-19(21)13-14-28(22)24(27-15-17-30-18-16-27)29(23)20-10-5-4-6-11-20;/h4-14,26H,15-18H2,1-3H3;1H/q+1;/p-1
InChIKey YLRVPGPYGOLHKH-UHFFFAOYSA-M
Mol Weight 436.99 g/mol
Molecular Formula C25H29ClN4O
Exact Mass 436.202989 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24mRB2u5EgR
Name 1-[(tert-Butyl)amino]-3-(morpholin-4-yl)-2-phenyl-2H-imidazo[5,1-a]isoquinolinium Chloride
Alternate Name(s) 1-(tert-butylamino)-3-morpholino-2-phenyl-2H-imidazo[5,1-a]isoquinolin-4-ium chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29ClN4O
InChI InChI=1S/C25H29N4O.ClH/c1-25(2,3)26-23-22-21-12-8-7-9-19(21)13-14-28(22)24(27-15-17-30-18-16-27)29(23)20-10-5-4-6-11-20;/h4-14,26H,15-18H2,1-3H3;1H/q+1;/p-1
InChIKey YLRVPGPYGOLHKH-UHFFFAOYSA-M
Literature Reference DOI 10.1002/hlca.200900216
Molecular Weight 436.987 g/mol
SMILES N(c1[n](c([n+]2ccc3ccccc3c12)N1CCOCC1)-c1ccccc1)C(C)(C)C.[Cl-]
SPLASH splash10-054o-8947000000-97f14636cc28dd60a141
Source of Spectrum H-93-74-4a
Wiley ID 1785779