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1H-thieno[2,3-c]pyrazole-5-carboxamide, N-[1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-4-yl]-1-methyl-3-(trifluoromethyl)-
SpectraBase Compound ID DwFTPZ8NnZ7
InChI InChI=1S/C18H12ClF4N5OS/c1-27-17-10(15(26-27)18(21,22)23)5-14(30-17)16(29)25-9-6-24-28(7-9)8-11-12(19)3-2-4-13(11)20/h2-7H,8H2,1H3,(H,25,29)
InChIKey GSQQSEUCLRPJHY-UHFFFAOYSA-N
Mol Weight 457.83 g/mol
Molecular Formula C18H12ClF4N5OS
Exact Mass 457.038722 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IjmQqrYkNpS
Name 1H-thieno[2,3-c]pyrazole-5-carboxamide, N-[1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-4-yl]-1-methyl-3-(trifluoromethyl)-
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/C18H12ClF4N5OS/c1-27-17-10(15(26-27)18(21,22)23)5-14(30-17)16(29)25-9-6-24-28(7-9)8-11-12(19)3-2-4-13(11)20/h2-7H,8H2,1H3,(H,25,29)
InChIKey GSQQSEUCLRPJHY-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_25854
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: 2011786; UZI_ID: UZI-025864
Temperature 308 °C