2,3-Dihydro-1-[2-(1H-indol-3-yl)ethyl]-4-methoxypyridinium Trifluoromethanesulfonate

SpectraBase Compound ID	qpIEVaVHl0
InChI	InChI=1S/C16H19N2O.CHF3O3S/c1-19-14-7-10-18(11-8-14)9-6-13-12-17-16-5-3-2-4-15(13)16;2-1(3,4)8(5,6)7/h2-5,7,10,12,17H,6,8-9,11H2,1H3;(H,5,6,7)/q+1;/p-1
InChIKey	MDWPFJDRLRLAGH-UHFFFAOYSA-M Google Search
Mol Weight	404.4 g/mol
Molecular Formula	C17H19F3N2O4S
Exact Mass	404.101763 g/mol

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SpectraBase Spectrum ID	3MLP08MQHsf
Name	2,3-Dihydro-1-[2-(1H-indol-3-yl)ethyl]-4-methoxypyridinium Trifluoromethanesulfonate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H19F3N2O4S
InChI	InChI=1S/C16H19N2O.CHF3O3S/c1-19-14-7-10-18(11-8-14)9-6-13-12-17-16-5-3-2-4-15(13)16;2-1(3,4)8(5,6)7/h2-5,7,10,12,17H,6,8-9,11H2,1H3;(H,5,6,7)/q+1;/p-1
InChIKey	MDWPFJDRLRLAGH-UHFFFAOYSA-M
Molecular Weight	404.404 g/mol
SMILES	[nH]1c2c(c(c1)CC[N+]1=CC=C(CC1)OC)cccc2.C(S([O-])(=O)=O)(F)(F)F
SPLASH	splash10-02ai-7900000000-55c971d07060f83f291e
Source of Spectrum	J-56-2708-37
Synonyms	1-[2-(1H-indol-3-yl)ethyl]-4-methoxy-2,3-dihydropyridinium trifluoromethanesulfonate
Wiley ID	1371061