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2-butanone, 4-[[4-[[4-[(3-oxobutyl)sulfonyl]phenyl]methyl]phenyl]sulfonyl]-
SpectraBase Compound ID Djkx8oRXVfd
InChI InChI=1S/C21H24O6S2/c1-16(22)11-13-28(24,25)20-7-3-18(4-8-20)15-19-5-9-21(10-6-19)29(26,27)14-12-17(2)23/h3-10H,11-15H2,1-2H3
InChIKey PRHVLIQUGJDCPL-UHFFFAOYSA-N
Mol Weight 436.54 g/mol
Molecular Formula C21H24O6S2
Exact Mass 436.101431 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5JjqaWD9jOh
Name 2-butanone, 4-[[4-[[4-[(3-oxobutyl)sulfonyl]phenyl]methyl]phenyl]sulfonyl]-
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/C21H24O6S2/c1-16(22)11-13-28(24,25)20-7-3-18(4-8-20)15-19-5-9-21(10-6-19)29(26,27)14-12-17(2)23/h3-10H,11-15H2,1-2H3
InChIKey PRHVLIQUGJDCPL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_4054
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/5100818; Labnumber: AI-1285; IOH_ID: IOH-011057