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N-[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]-4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide

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N-[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]-4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
SpectraBase Compound ID ETN2bgolVMD
InChI InChI=1S/C14H12BrF3N4O2S/c1-22-9(8(15)10(21-22)14(16,17)18)12(24)20-13-7(11(19)23)5-3-2-4-6(5)25-13/h2-4H2,1H3,(H2,19,23)(H,20,24)
InChIKey KIWCEJUFTYFUHV-UHFFFAOYSA-N
Mol Weight 437.24 g/mol
Molecular Formula C14H12BrF3N4O2S
Exact Mass 435.981644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3dnojJMpxll
Name N-[3-(aminocarbonyl)-5,6-dihydro-4H-cyclopenta[b]thien-2-yl]-4-bromo-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-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/C14H12BrF3N4O2S/c1-22-9(8(15)10(21-22)14(16,17)18)12(24)20-13-7(11(19)23)5-3-2-4-6(5)25-13/h2-4H2,1H3,(H2,19,23)(H,20,24)
InChIKey KIWCEJUFTYFUHV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_990
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/1091298; Labnumber: AC-NHALL/0416261; UZI_ID: UZI-000992
Temperature 308 °C