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1'-((5-bromothiophen-2-yl)sulfonyl)-4'-chloro-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole

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1'-((5-bromothiophen-2-yl)sulfonyl)-4'-chloro-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
SpectraBase Compound ID K2yCmMWPMIV
InChI InChI=1S/C15H12BrClN6O2S2/c1-21-7-9(5-18-21)14-13(17)15(10-6-19-22(2)8-10)23(20-14)27(24,25)12-4-3-11(16)26-12/h3-8H,1-2H3
InChIKey PKHAKJYZGHRAOL-UHFFFAOYSA-N
Mol Weight 487.78 g/mol
Molecular Formula C15H12BrClN6O2S2
Exact Mass 485.933507 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HfLEGtjqKVV
Name 1'-((5-bromothiophen-2-yl)sulfonyl)-4'-chloro-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
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/C15H12BrClN6O2S2/c1-21-7-9(5-18-21)14-13(17)15(10-6-19-22(2)8-10)23(20-14)27(24,25)12-4-3-11(16)26-12/h3-8H,1-2H3
InChIKey PKHAKJYZGHRAOL-UHFFFAOYSA-N
NMR Offset 17.9118
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31385
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: 1774315; SBI_ID: SBI-031389
Temperature 303 °C