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1-allyl-4-(2-{[hydroxy(diphenyl)acetyl]oxy}ethyl)piperazinediium dichloride
SpectraBase Compound ID CShxL92gLMK
InChI InChI=1S/C23H28N2O3.2ClH/c1-2-13-24-14-16-25(17-15-24)18-19-28-22(26)23(27,20-9-5-3-6-10-20)21-11-7-4-8-12-21;;/h2-12,27H,1,13-19H2;2*1H
InChIKey YVCKRGVBALEBNV-UHFFFAOYSA-N
Mol Weight 453.41 g/mol
Molecular Formula C23H30Cl2N2O3
Exact Mass 452.163348 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1z199gYXU6W
Name 1-allyl-4-(2-{[hydroxy(diphenyl)acetyl]oxy}ethyl)piperazinediiumdichloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.163348231 u
Formula C23H30Cl2N2O3
InChI InChI=1S/C23H28N2O3.2ClH/c1-2-13-24-14-16-25(17-15-24)18-19-28-22(26)23(27,20-9-5-3-6-10-20)21-11-7-4-8-12-21;;/h2-12,27H,1,13-19H2;2*1H
InChIKey YVCKRGVBALEBNV-UHFFFAOYSA-N
Molecular Weight 453.410 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_8782
Solvent DMSO-d6
Source Vendor ID: NMR/13228066