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pyridinium, 3-[[[(5-chloro-2-ethoxy-3-methoxyphenyl)methyl]ammonio]methyl]-, dichloride
SpectraBase Compound ID FgffHkxzfTX
InChI InChI=1S/C16H19ClN2O2.2ClH/c1-3-21-16-13(7-14(17)8-15(16)20-2)11-19-10-12-5-4-6-18-9-12;;/h4-9,19H,3,10-11H2,1-2H3;2*1H
InChIKey VFZMJDHUVYTWMA-UHFFFAOYSA-N
Mol Weight 379.72 g/mol
Molecular Formula C16H21Cl3N2O2
Exact Mass 378.066861 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DMxjf9rlA7R
Name pyridinium, 3-[[[(5-chloro-2-ethoxy-3-methoxyphenyl)methyl]ammonio]methyl]-, dichloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C16H19ClN2O2.2ClH/c1-3-21-16-13(7-14(17)8-15(16)20-2)11-19-10-12-5-4-6-18-9-12;;/h4-9,19H,3,10-11H2,1-2H3;2*1H
InChIKey VFZMJDHUVYTWMA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6120
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/18211514; Labnumber: LT-1188X1206