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isopropyl 2-({[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-4,5-dimethyl-3-thiophenecarboxylate
SpectraBase Compound ID LmK59XQCL6Z
InChI InChI=1S/C17H19BrF3N3O3S/c1-7(2)27-16(26)12-8(3)10(5)28-15(12)22-11(25)6-24-9(4)13(18)14(23-24)17(19,20)21/h7H,6H2,1-5H3,(H,22,25)
InChIKey FMEDEBMODGMDQQ-UHFFFAOYSA-N
Mol Weight 482.32 g/mol
Molecular Formula C17H19BrF3N3O3S
Exact Mass 481.02826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Agf4rX4jLni
Name isopropyl 2-({[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-4,5-dimethyl-3-thiophenecarboxylate
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/C17H19BrF3N3O3S/c1-7(2)27-16(26)12-8(3)10(5)28-15(12)22-11(25)6-24-9(4)13(18)14(23-24)17(19,20)21/h7H,6H2,1-5H3,(H,22,25)
InChIKey FMEDEBMODGMDQQ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16154
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/8074329; UBI_ID: UBI-016157
Temperature 308 °C