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methyl 3-chloro-6-{[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanoyl]amino}-1-benzothiophene-2-carboxylate
SpectraBase Compound ID AIbzEYjlTb3
InChI InChI=1S/C19H19Cl2N3O3S/c1-9(8-24-11(3)15(20)10(2)23-24)18(25)22-12-5-6-13-14(7-12)28-17(16(13)21)19(26)27-4/h5-7,9H,8H2,1-4H3,(H,22,25)
InChIKey HABYUWUMHZAUEW-UHFFFAOYSA-N
Mol Weight 440.35 g/mol
Molecular Formula C19H19Cl2N3O3S
Exact Mass 439.052418 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EETiYfdgeuA
Name methyl 3-chloro-6-{[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-methylpropanoyl]amino}-1-benzothiophene-2-carboxylate
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/C19H19Cl2N3O3S/c1-9(8-24-11(3)15(20)10(2)23-24)18(25)22-12-5-6-13-14(7-12)28-17(16(13)21)19(26)27-4/h5-7,9H,8H2,1-4H3,(H,22,25)
InChIKey HABYUWUMHZAUEW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_30019
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: 1547080; SBI_ID: SBI-030023
Temperature 318 °C