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3-pyridinemethanaminium, N-[[5-(4-bromo-2-methylphenyl)-2-furanyl]methyl]-, chloride
SpectraBase Compound ID IIXvZhfg9G8
InChI InChI=1S/C18H17BrN2O.ClH/c1-13-9-15(19)4-6-17(13)18-7-5-16(22-18)12-21-11-14-3-2-8-20-10-14;/h2-10,21H,11-12H2,1H3;1H
InChIKey KDQKDJKNXUZMGZ-UHFFFAOYSA-N
Mol Weight 393.71 g/mol
Molecular Formula C18H18BrClN2O
Exact Mass 392.029104 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Gq3zxdREt5o
Name 3-pyridinemethanaminium, N-[[5-(4-bromo-2-methylphenyl)-2-furanyl]methyl]-, chloride
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/C18H17BrN2O.ClH/c1-13-9-15(19)4-6-17(13)18-7-5-16(22-18)12-21-11-14-3-2-8-20-10-14;/h2-10,21H,11-12H2,1H3;1H
InChIKey KDQKDJKNXUZMGZ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3605
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: F17953; Labnumber: SPHRAM1-31094