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pyrrolidinium, 1-ethyl-2-[[[[3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl]methyl]ammonio]methyl]-, dichloride
SpectraBase Compound ID 4OY4q5K507V
InChI InChI=1S/C22H28N6O2.2ClH/c1-3-27-13-7-10-19(27)16-23-15-17-11-12-20(21(14-17)29-2)30-22-24-25-26-28(22)18-8-5-4-6-9-18;;/h4-6,8-9,11-12,14,19,23H,3,7,10,13,15-16H2,1-2H3;2*1H
InChIKey URDSQAQTTUMFBC-UHFFFAOYSA-N
Mol Weight 481.43 g/mol
Molecular Formula C22H30Cl2N6O2
Exact Mass 480.18073 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8aqKvRUxMPK
Name pyrrolidinium, 1-ethyl-2-[[[[3-methoxy-4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl]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/C22H28N6O2.2ClH/c1-3-27-13-7-10-19(27)16-23-15-17-11-12-20(21(14-17)29-2)30-22-24-25-26-28(22)18-8-5-4-6-9-18;;/h4-6,8-9,11-12,14,19,23H,3,7,10,13,15-16H2,1-2H3;2*1H
InChIKey URDSQAQTTUMFBC-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_8388
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: F32127; Labnumber: SPHRAM1-41162