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1-methyl-4-(2-{[(3-methylphenoxy)acetyl]oxy}propyl)piperazinediium dichloride
SpectraBase Compound ID GdthFcYneT6
InChI InChI=1S/C17H26N2O3.2ClH/c1-14-5-4-6-16(11-14)21-13-17(20)22-15(2)12-19-9-7-18(3)8-10-19;;/h4-6,11,15H,7-10,12-13H2,1-3H3;2*1H
InChIKey CGDVDFUVWRTKTA-UHFFFAOYSA-N
Mol Weight 379.33 g/mol
Molecular Formula C17H28Cl2N2O3
Exact Mass 378.147698 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2PvAp4yWB4U
Name 1-methyl-4-(2-{[(3-methylphenoxy)acetyl]oxy}propyl)piperazinediium 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/C17H26N2O3.2ClH/c1-14-5-4-6-16(11-14)21-13-17(20)22-15(2)12-19-9-7-18(3)8-10-19;;/h4-6,11,15H,7-10,12-13H2,1-3H3;2*1H
InChIKey CGDVDFUVWRTKTA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7816
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: D32333; Labnumber: BAL3-5198; SBI_ID: SBI-007819
Temperature 315 °C