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diethyl 5-{[(4-bromo-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino}-3-methyl-2,4-thiophenedicarboxylate
SpectraBase Compound ID BsXgKsWcGt5
InChI InChI=1S/C17H20BrN3O5S/c1-5-21-8-10(18)12(20-21)14(22)19-15-11(16(23)25-6-2)9(4)13(27-15)17(24)26-7-3/h8H,5-7H2,1-4H3,(H,19,22)
InChIKey ZTRKZAQWVUUGMP-UHFFFAOYSA-N
Mol Weight 458.33 g/mol
Molecular Formula C17H20BrN3O5S
Exact Mass 457.030705 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DzBbF9cqYEx
Name diethyl 5-{[(4-bromo-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino}-3-methyl-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/C17H20BrN3O5S/c1-5-21-8-10(18)12(20-21)14(22)19-15-11(16(23)25-6-2)9(4)13(27-15)17(24)26-7-3/h8H,5-7H2,1-4H3,(H,19,22)
InChIKey ZTRKZAQWVUUGMP-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2471
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: 9312647; UBI_ID: UBI-002472
Temperature 313 °C