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1H-1,2,3-triazole-4-carboxamide, 1-(3-chlorophenyl)-5-methyl-N-[4-(4-methyl-1-piperazinyl)phenyl]-
SpectraBase Compound ID Du0XDwU7NVs
InChI InChI=1S/C21H23ClN6O/c1-15-20(24-25-28(15)19-5-3-4-16(22)14-19)21(29)23-17-6-8-18(9-7-17)27-12-10-26(2)11-13-27/h3-9,14H,10-13H2,1-2H3,(H,23,29)
InChIKey XYGGFQQJNNCYQO-UHFFFAOYSA-N
Mol Weight 410.91 g/mol
Molecular Formula C21H23ClN6O
Exact Mass 410.162187 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EG0uTCJ2zt
Name 1H-1,2,3-triazole-4-carboxamide, 1-(3-chlorophenyl)-5-methyl-N-[4-(4-methyl-1-piperazinyl)phenyl]-
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/C21H23ClN6O/c1-15-20(24-25-28(15)19-5-3-4-16(22)14-19)21(29)23-17-6-8-18(9-7-17)27-12-10-26(2)11-13-27/h3-9,14H,10-13H2,1-2H3,(H,23,29)
InChIKey XYGGFQQJNNCYQO-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_7580
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: F30740