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4-chloro-5-{4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}-2-phenyl-3(2H)-pyridazinone
SpectraBase Compound ID KDHuMspi3bm
InChI InChI=1S/C21H21ClN4O3S/c1-16-7-9-18(10-8-16)30(28,29)25-13-11-24(12-14-25)19-15-23-26(21(27)20(19)22)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3
InChIKey CSRGLZZLWQSAMZ-UHFFFAOYSA-N
Mol Weight 444.94 g/mol
Molecular Formula C21H21ClN4O3S
Exact Mass 444.102289 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H9BCrsHlSKe
Name 4-chloro-5-{4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}-2-phenyl-3(2H)-pyridazinone
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/C21H21ClN4O3S/c1-16-7-9-18(10-8-16)30(28,29)25-13-11-24(12-14-25)19-15-23-26(21(27)20(19)22)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3
InChIKey CSRGLZZLWQSAMZ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24296
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: D46424; Labnumber: SPKUZ-2445; SBI_ID: SBI-024300
Temperature 308 °C