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3-chloro-N-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-2-carboxamide

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3-chloro-N-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-2-carboxamide
SpectraBase Compound ID BtXaa0t2MoK
InChI InChI=1S/C21H16Cl3N3OS/c1-11-19(12(2)27(26-11)10-13-7-8-14(22)9-16(13)23)25-21(28)20-18(24)15-5-3-4-6-17(15)29-20/h3-9H,10H2,1-2H3,(H,25,28)
InChIKey BFPQZJBFQHUKLG-UHFFFAOYSA-N
Mol Weight 464.8 g/mol
Molecular Formula C21H16Cl3N3OS
Exact Mass 463.007966 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FmVd0Fm5EQC
Name 3-chloro-N-[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-1-benzothiophene-2-carboxamide
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/C21H16Cl3N3OS/c1-11-19(12(2)27(26-11)10-13-7-8-14(22)9-16(13)23)25-21(28)20-18(24)15-5-3-4-6-17(15)29-20/h3-9H,10H2,1-2H3,(H,25,28)
InChIKey BFPQZJBFQHUKLG-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1382
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: 9170802; UBI_ID: UBI-001383
Temperature 308 °C