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N-[1,1'-biphenyl]-4-yl-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-3-isoxazolecarboxamide
SpectraBase Compound ID BbcpO3QcYn8
InChI InChI=1S/C23H21N5O4/c1-14-22(28(30)31)15(2)27(25-14)13-20-16(3)32-26-21(20)23(29)24-19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-12H,13H2,1-3H3,(H,24,29)
InChIKey UFQXRXZIEWTNQG-UHFFFAOYSA-N
Mol Weight 431.45 g/mol
Molecular Formula C23H21N5O4
Exact Mass 431.159354 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EyKEbSziUEK
Name N-[1,1'-biphenyl]-4-yl-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/C23H21N5O4/c1-14-22(28(30)31)15(2)27(25-14)13-20-16(3)32-26-21(20)23(29)24-19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-12H,13H2,1-3H3,(H,24,29)
InChIKey UFQXRXZIEWTNQG-UHFFFAOYSA-N
NMR Offset 17.9122
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_32923
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: 1911753; SBI_ID: SBI-032927
Temperature 303 °C