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4'-chloro-1'-((4-chlorophenyl)sulfonyl)-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole

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4'-chloro-1'-((4-chlorophenyl)sulfonyl)-1,1''-dimethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
SpectraBase Compound ID ITmoVAUs4Qt
InChI InChI=1S/C17H14Cl2N6O2S/c1-23-9-11(7-20-23)16-15(19)17(12-8-21-24(2)10-12)25(22-16)28(26,27)14-5-3-13(18)4-6-14/h3-10H,1-2H3
InChIKey BKVDMYJUEFWRAL-UHFFFAOYSA-N
Mol Weight 437.31 g/mol
Molecular Formula C17H14Cl2N6O2S
Exact Mass 436.0276 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9cxXCJPK3eH
Name 4'-chloro-1'-((4-chlorophenyl)sulfonyl)-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/C17H14Cl2N6O2S/c1-23-9-11(7-20-23)16-15(19)17(12-8-21-24(2)10-12)25(22-16)28(26,27)14-5-3-13(18)4-6-14/h3-10H,1-2H3
InChIKey BKVDMYJUEFWRAL-UHFFFAOYSA-N
NMR Offset 17.9116
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31316
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: 1765431; SBI_ID: SBI-031320
Temperature 303 °C