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3-(2-chlorophenyl)-5-methyl-N-[1-(4-methylbenzyl)-1H-pyrazol-3-yl]-4-isoxazolecarboxamide
SpectraBase Compound ID 4MiWjlzMSWc
InChI InChI=1S/C22H19ClN4O2/c1-14-7-9-16(10-8-14)13-27-12-11-19(25-27)24-22(28)20-15(2)29-26-21(20)17-5-3-4-6-18(17)23/h3-12H,13H2,1-2H3,(H,24,25,28)
InChIKey QRRASSCLFCZNNO-UHFFFAOYSA-N
Mol Weight 406.87 g/mol
Molecular Formula C22H19ClN4O2
Exact Mass 406.119654 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8sgYemPNr1y
Name 3-(2-chlorophenyl)-5-methyl-N-[1-(4-methylbenzyl)-1H-pyrazol-3-yl]-4-isoxazolecarboxamide
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/C22H19ClN4O2/c1-14-7-9-16(10-8-14)13-27-12-11-19(25-27)24-22(28)20-15(2)29-26-21(20)17-5-3-4-6-18(17)23/h3-12H,13H2,1-2H3,(H,24,25,28)
InChIKey QRRASSCLFCZNNO-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_4086
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: UZI/9143855; Labnumber: BAM_UACK/002073; UZI_ID: UZI-004088
Temperature 313 °C