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quinoline, 8-[[2-nitro-5-[4-(phenylsulfonyl)-1-piperazinyl]phenyl]thio]-
SpectraBase Compound ID 64JhzZQeWUt
InChI InChI=1S/C25H22N4O4S2/c30-29(31)22-12-11-20(18-24(22)34-23-10-4-6-19-7-5-13-26-25(19)23)27-14-16-28(17-15-27)35(32,33)21-8-2-1-3-9-21/h1-13,18H,14-17H2
InChIKey UADSZLDJOHWLHZ-UHFFFAOYSA-N
Mol Weight 506.6 g/mol
Molecular Formula C25H22N4O4S2
Exact Mass 506.108248 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JyAIoUFqBag
Name quinoline, 8-[[2-nitro-5-[4-(phenylsulfonyl)-1-piperazinyl]phenyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 506.108247548 u
Formula C25H22N4O4S2
InChI InChI=1S/C25H22N4O4S2/c30-29(31)22-12-11-20(18-24(22)34-23-10-4-6-19-7-5-13-26-25(19)23)27-14-16-28(17-15-27)35(32,33)21-8-2-1-3-9-21/h1-13,18H,14-17H2
InChIKey UADSZLDJOHWLHZ-UHFFFAOYSA-N
Molecular Weight 506.595 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6858
Solvent DMSO-d6
Source Vendor ID: NMR/9321052; Lab Info: LP; Lab Number: LP-2501075