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N-(2-benzoyl-4-chlorophenyl)-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-3-isoxazolecarboxamide
SpectraBase Compound ID 1up02zS6jfv
InChI InChI=1S/C24H20ClN5O5/c1-13-22(30(33)34)14(2)29(27-13)12-19-15(3)35-28-21(19)24(32)26-20-10-9-17(25)11-18(20)23(31)16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H,26,32)
InChIKey QDKZXPUUNJLSIB-UHFFFAOYSA-N
Mol Weight 493.91 g/mol
Molecular Formula C24H20ClN5O5
Exact Mass 493.115296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IRrEuyeMolj
Name N-(2-benzoyl-4-chlorophenyl)-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-3-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/C24H20ClN5O5/c1-13-22(30(33)34)14(2)29(27-13)12-19-15(3)35-28-21(19)24(32)26-20-10-9-17(25)11-18(20)23(31)16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H,26,32)
InChIKey QDKZXPUUNJLSIB-UHFFFAOYSA-N
NMR Offset 17.9122
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_33006
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: 1911887; SBI_ID: SBI-033010
Temperature 303 °C