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2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[2-(methylsulfanyl)phenyl]acetamide
SpectraBase Compound ID 3OWLQCsZIJV
InChI InChI=1S/C14H13BrF3N3OS/c1-8-12(15)13(14(16,17)18)20-21(8)7-11(22)19-9-5-3-4-6-10(9)23-2/h3-6H,7H2,1-2H3,(H,19,22)
InChIKey LDRUPSNFVZBBKF-UHFFFAOYSA-N
Mol Weight 408.24 g/mol
Molecular Formula C14H13BrF3N3OS
Exact Mass 406.991481 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2vmD4YIUXO9
Name 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[2-(methylsulfanyl)phenyl]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/C14H13BrF3N3OS/c1-8-12(15)13(14(16,17)18)20-21(8)7-11(22)19-9-5-3-4-6-10(9)23-2/h3-6H,7H2,1-2H3,(H,19,22)
InChIKey LDRUPSNFVZBBKF-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9473
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/8013475; Labnumber: IDV-0001528; UZI_ID: UZI-009475
Temperature 318 °C