1-(4-bromophenyl)-2-[2-methyl-5-[2-(6-methyl-3-pyridinyl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-2-yl]ethanone

SpectraBase Compound ID	GaESDtZydNV
InChI	InChI=1S/C28H29BrN3O/c1-20-7-8-21(17-30-20)13-15-31-26-6-4-3-5-24(26)25-18-32(2,16-14-27(25)31)19-28(33)22-9-11-23(29)12-10-22/h3-12,17H,13-16,18-19H2,1-2H3/q+1
InChIKey	KHCHFGOIHAGRSC-UHFFFAOYSA-N Google Search
Mol Weight	503.46 g/mol
Molecular Formula	C28H29BrN3O
Exact Mass	502.149401 g/mol

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SpectraBase Spectrum ID	3tDdYoI8Zbs
Name	1-(4-bromophenyl)-2-[2-methyl-5-[2-(6-methyl-3-pyridinyl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-2-yl]ethanone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C28H29BrN3O
InChI	InChI=1S/C28H29BrN3O/c1-20-7-8-21(17-30-20)13-15-31-26-6-4-3-5-24(26)25-18-32(2,16-14-27(25)31)19-28(33)22-9-11-23(29)12-10-22/h3-12,17H,13-16,18-19H2,1-2H3/q+1
InChIKey	KHCHFGOIHAGRSC-UHFFFAOYSA-N
Molecular Weight	503.464 g/mol
SMILES	c12c([n](CCc3cnc(cc3)C)c3c1cccc3)CC[N+](C2)(CC(c1ccc(cc1)Br)=O)C
SPLASH	splash10-052f-9801000000-668a30002bb8039bf736
Source of Spectrum	AD-0-2532-0
Synonyms	1-(4-bromophenyl)-2-[2-methyl-5-[2-(6-methyl-3-pyridyl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-2-yl]ethanone 1-(4-bromophenyl)-2-[2-methyl-5-[2-(6-methyl-3-pyridyl)ethyl]-3,4-dihydro-1H-pyrid[4,3-b]indol-2-ium-2-yl]ethanone 1-(4-bromophenyl)-2-[2-methyl-5-[2-(6-methylpyridin-3-yl)ethyl]-3,4-dihydro-1H-pyrido[4,3-b]indol-2-ium-2-yl]ethanone
Wiley ID	1435851