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4-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-(2-methylphenyl)-1-pentanaminium chloride
SpectraBase Compound ID FxQG68WbGkx
InChI InChI=1S/C24H32N2O2.ClH/c1-19-9-6-7-10-21(19)24(2,18-25)14-8-15-26(3)16-13-20-11-12-22(27-4)23(17-20)28-5;/h6-7,9-12,17H,8,13-16H2,1-5H3;1H
InChIKey BMWREJTZXBFKNQ-UHFFFAOYSA-N
Mol Weight 417.0 g/mol
Molecular Formula C24H33ClN2O2
Exact Mass 416.223056 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EfPGsxXxGzb
Name 4-cyano-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-4-(2-methylphenyl)-1-pentanaminium 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/C24H32N2O2.ClH/c1-19-9-6-7-10-21(19)24(2,18-25)14-8-15-26(3)16-13-20-11-12-22(27-4)23(17-20)28-5;/h6-7,9-12,17H,8,13-16H2,1-5H3;1H
InChIKey BMWREJTZXBFKNQ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_17372
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: 987/00005432; Labnumber: 987/00005432218866; VK_ID: VK-017377
Temperature 308 °C