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4'-chloro-1,1'',3,3''-tetramethyl-1'-(thiophen-2-ylsulfonyl)-1H,1'H,1''H-4,3':5',4''-terpyrazole

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4'-chloro-1,1'',3,3''-tetramethyl-1'-(thiophen-2-ylsulfonyl)-1H,1'H,1''H-4,3':5',4''-terpyrazole
SpectraBase Compound ID 9zjzpaCWf0n
InChI InChI=1S/C17H17ClN6O2S2/c1-10-12(8-22(3)19-10)16-15(18)17(13-9-23(4)20-11(13)2)24(21-16)28(25,26)14-6-5-7-27-14/h5-9H,1-4H3
InChIKey JMGWHYPRVZLXKU-UHFFFAOYSA-N
Mol Weight 436.94 g/mol
Molecular Formula C17H17ClN6O2S2
Exact Mass 436.054294 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8yuG95ayCs3
Name 4'-chloro-1,1'',3,3''-tetramethyl-1'-(thiophen-2-ylsulfonyl)-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/C17H17ClN6O2S2/c1-10-12(8-22(3)19-10)16-15(18)17(13-9-23(4)20-11(13)2)24(21-16)28(25,26)14-6-5-7-27-14/h5-9H,1-4H3
InChIKey JMGWHYPRVZLXKU-UHFFFAOYSA-N
NMR Offset 17.912
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31345
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: 1769334; SBI_ID: SBI-031349
Temperature 303 °C