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N-[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-nitrobenzenesulfonamide
SpectraBase Compound ID JaBvRFFu3A1
InChI InChI=1S/C18H17FN4O4S/c1-12-18(13(2)22(20-12)11-14-7-9-15(19)10-8-14)21-28(26,27)17-6-4-3-5-16(17)23(24)25/h3-10,21H,11H2,1-2H3
InChIKey BRFRNNRNIWKASG-UHFFFAOYSA-N
Mol Weight 404.42 g/mol
Molecular Formula C18H17FN4O4S
Exact Mass 404.095454 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5KnN5puoBs2
Name N-[1-(4-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-nitrobenzenesulfonamide
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/C18H17FN4O4S/c1-12-18(13(2)22(20-12)11-14-7-9-15(19)10-8-14)21-28(26,27)17-6-4-3-5-16(17)23(24)25/h3-10,21H,11H2,1-2H3
InChIKey BRFRNNRNIWKASG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_19687
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/9147880; UBI_ID: UBI-019691
Temperature 318 °C