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5-{[4-(2,6-dichlorobenzyl)-1-piperazinyl]carbonyl}-N,N-diethyl-1-methyl-1H-pyrazole-3-carboxamide
SpectraBase Compound ID fMSWnpPOyS
InChI InChI=1S/C21H27Cl2N5O2/c1-4-27(5-2)20(29)18-13-19(25(3)24-18)21(30)28-11-9-26(10-12-28)14-15-16(22)7-6-8-17(15)23/h6-8,13H,4-5,9-12,14H2,1-3H3
InChIKey PTZCPJCFXUMGSJ-UHFFFAOYSA-N
Mol Weight 452.39 g/mol
Molecular Formula C21H27Cl2N5O2
Exact Mass 451.154181 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HvYGFBmYYf8
Name 5-{[4-(2,6-dichlorobenzyl)-1-piperazinyl]carbonyl}-N,N-diethyl-1-methyl-1H-pyrazole-3-carboxamide
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/C21H27Cl2N5O2/c1-4-27(5-2)20(29)18-13-19(25(3)24-18)21(30)28-11-9-26(10-12-28)14-15-16(22)7-6-8-17(15)23/h6-8,13H,4-5,9-12,14H2,1-3H3
InChIKey PTZCPJCFXUMGSJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_33336
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: 1927283; SBI_ID: SBI-033340
Temperature 318 °C