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1'-((5-bromothiophen-2-yl)sulfonyl)-1,1'',3,3''-tetramethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole
SpectraBase Compound ID 8LEcZ9ULvQq
InChI InChI=1S/C17H17BrN6O2S2/c1-10-12(8-22(3)19-10)14-7-15(13-9-23(4)20-11(13)2)24(21-14)28(25,26)17-6-5-16(18)27-17/h5-9H,1-4H3
InChIKey YSZKBWDEUWPJLK-UHFFFAOYSA-N
Mol Weight 481.39 g/mol
Molecular Formula C17H17BrN6O2S2
Exact Mass 480.003779 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LxvchKjWF3v
Name 1'-((5-bromothiophen-2-yl)sulfonyl)-1,1'',3,3''-tetramethyl-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/C17H17BrN6O2S2/c1-10-12(8-22(3)19-10)14-7-15(13-9-23(4)20-11(13)2)24(21-14)28(25,26)17-6-5-16(18)27-17/h5-9H,1-4H3
InChIKey YSZKBWDEUWPJLK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31285
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: 1755058; SBI_ID: SBI-031289
Temperature 318 °C