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N-(4-{[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl}phenyl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide
SpectraBase Compound ID BcWynwzMdO5
InChI InChI=1S/C16H16N6O6S/c1-10-11(2)19-28-16(10)20-29(26,27)14-5-3-12(4-6-14)18-15(23)9-21-8-13(7-17-21)22(24)25/h3-8,20H,9H2,1-2H3,(H,18,23)
InChIKey VWSIXDQKYPPDGI-UHFFFAOYSA-N
Mol Weight 420.4 g/mol
Molecular Formula C16H16N6O6S
Exact Mass 420.085203 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8qPW7PyOqOn
Name N-(4-{[(3,4-dimethyl-5-isoxazolyl)amino]sulfonyl}phenyl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide
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/C16H16N6O6S/c1-10-11(2)19-28-16(10)20-29(26,27)14-5-3-12(4-6-14)18-15(23)9-21-8-13(7-17-21)22(24)25/h3-8,20H,9H2,1-2H3,(H,18,23)
InChIKey VWSIXDQKYPPDGI-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_34715
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: 9163922; SBI_ID: SBI-034719
Temperature 318 °C