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2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
SpectraBase Compound ID Iqckuhqnrro
InChI InChI=1S/C20H16ClN5O3S/c1-11-3-8-15-16(9-11)30-20(23-15)13-4-6-14(7-5-13)22-17(27)10-25-12(2)18(21)19(24-25)26(28)29/h3-9H,10H2,1-2H3,(H,22,27)
InChIKey WWIHXCOXPPEJJU-UHFFFAOYSA-N
Mol Weight 441.89 g/mol
Molecular Formula C20H16ClN5O3S
Exact Mass 441.066238 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ff7kPfJjDyE
Name 2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide
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/C20H16ClN5O3S/c1-11-3-8-15-16(9-11)30-20(23-15)13-4-6-14(7-5-13)22-17(27)10-25-12(2)18(21)19(24-25)26(28)29/h3-9H,10H2,1-2H3,(H,22,27)
InChIKey WWIHXCOXPPEJJU-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_11670
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/9099002; UBI_ID: UBI-011673
Temperature 308 °C