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5-isoxazolecarboxamide, N-[1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl]-4,5-dihydro-3-(2-methoxyphenyl)-
SpectraBase Compound ID AFTKcUjzD2j
InChI InChI=1S/C21H19BrN4O4/c1-28-19-5-3-2-4-17(19)18-10-20(30-25-18)21(27)24-15-11-23-26(12-15)13-29-16-8-6-14(22)7-9-16/h2-9,11-12,20H,10,13H2,1H3,(H,24,27)
InChIKey GIGACEKPJNRLTC-UHFFFAOYSA-N
Mol Weight 471.31 g/mol
Molecular Formula C21H19BrN4O4
Exact Mass 470.058968 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ENJHciogLPP
Name 5-isoxazolecarboxamide, N-[1-[(4-bromophenoxy)methyl]-1H-pyrazol-4-yl]-4,5-dihydro-3-(2-methoxyphenyl)-
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/C21H19BrN4O4/c1-28-19-5-3-2-4-17(19)18-10-20(30-25-18)21(27)24-15-11-23-26(12-15)13-29-16-8-6-14(22)7-9-16/h2-9,11-12,20H,10,13H2,1H3,(H,24,27)
InChIKey GIGACEKPJNRLTC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21473
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: 2180060; UZI_ID: UZI-021481
Temperature 308 °C