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1-[(3-chloro-1-benzothien-2-yl)carbonyl]-1H-pyrazole
SpectraBase Compound ID 4KsKNed44aY
InChI InChI=1S/C12H7ClN2OS/c13-10-8-4-1-2-5-9(8)17-11(10)12(16)15-7-3-6-14-15/h1-7H
InChIKey IHJULKXSFLGMPB-UHFFFAOYSA-N
Mol Weight 262.71 g/mol
Molecular Formula C12H7ClN2OS
Exact Mass 261.996762 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BgsmWGybUSz
Name 1-[(3-chloro-1-benzothien-2-yl)carbonyl]-1H-pyrazole
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/C12H7ClN2OS/c13-10-8-4-1-2-5-9(8)17-11(10)12(16)15-7-3-6-14-15/h1-7H
InChIKey IHJULKXSFLGMPB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_290
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: ZI/8038492; Labnumber: PNA-0005045