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diethyl 3-methyl-5-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-2,4-thiophenedicarboxylate
SpectraBase Compound ID BKHuKRP72DJ
InChI InChI=1S/C18H20F3N3O5S/c1-5-28-16(26)13-10(4)14(17(27)29-6-2)30-15(13)22-12(25)8-24-9(3)7-11(23-24)18(19,20)21/h7H,5-6,8H2,1-4H3,(H,22,25)
InChIKey ZUTZGTMDBHJEAI-UHFFFAOYSA-N
Mol Weight 447.43 g/mol
Molecular Formula C18H20F3N3O5S
Exact Mass 447.107576 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1WSqcbbywmR
Name diethyl 3-methyl-5-({[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-2,4-thiophenedicarboxylate
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/C18H20F3N3O5S/c1-5-28-16(26)13-10(4)14(17(27)29-6-2)30-15(13)22-12(25)8-24-9(3)7-11(23-24)18(19,20)21/h7H,5-6,8H2,1-4H3,(H,22,25)
InChIKey ZUTZGTMDBHJEAI-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_9441
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/8019739; Labnumber: IDV-0000704; UZI_ID: UZI-009443
Temperature 308 °C