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1-[3-(4-chloro-phenyl)-3-oxo-propenyl]-4-pyrrolidin-1-yl-pyridinium chloride
SpectraBase Compound ID BxJqqKMxGkh
InChI InChI=1S/C18H18ClN2O.ClH/c19-16-5-3-15(4-6-16)18(22)9-14-20-12-7-17(8-13-20)21-10-1-2-11-21;/h3-9,12-14H,1-2,10-11H2;1H/q+1;/p-1/b14-9+;
InChIKey ZYTBRSKPGGLLEE-KYIGKLDSSA-M
Mol Weight 349.26 g/mol
Molecular Formula C18H18Cl2N2O
Exact Mass 348.079619 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKDWDXIci9m
Name 1-[3-(4-chloro-phenyl)-3-oxo-propenyl]-4-pyrrolidin-1-yl-pyridinium chloride
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18Cl2N2O
InChI InChI=1S/C18H18ClN2O.ClH/c19-16-5-3-15(4-6-16)18(22)9-14-20-12-7-17(8-13-20)21-10-1-2-11-21;/h3-9,12-14H,1-2,10-11H2;1H/q+1;/p-1/b14-9+;
InChIKey ZYTBRSKPGGLLEE-KYIGKLDSSA-M
Molecular Weight 349.261 g/mol
SMILES [Cl-].C1CN(c2cc[n+](\C=C\C(c3ccc(Cl)cc3)=O)cc2)CC1
SPLASH splash10-0f9b-9600000000-32844f5ce2697bb9ee0a
Synonyms (E)-1-(4-chlorophenyl)-3-(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)prop-2-en-1-one chloride (E)-1-(4-chlorophenyl)-3-(4-pyrrolidinopyridin-1-ium-1-yl)prop-2-en-1-one chloride (E)-1-(4-chlorophenyl)-3-[4-(1-pyrrolidinyl)-1-pyridin-1-iumyl]-2-propen-1-one chloride 1-[(1E)-3-(4-chlorophenyl)-3-oxo-1-propenyl]-4-(1-pyrrolidinyl)pyridinium chloride 1-[3-(4-chlorophenyl)-3-oxo-1-propenyl]-4-(1-pyrrolidinyl)pyridinium chloride (E)-1-(4-chlorophenyl)-3-[4-(1-pyrrolidinyl)-1-pyridin-1-iumyl]-2-propen-1-one;chloride (E)-1-(4-chlorophenyl)-3-(4-pyrrolidin-1-ylpyridin-1-ium-1-yl)prop-2-en-1-one;chloride
Wiley ID 1452288