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1-{3-[(2-furylmethyl)sulfanyl]-4-nitrophenyl}-4-(phenylsulfonyl)piperazine
SpectraBase Compound ID GVK5sHcSD0m
InChI InChI=1S/C21H21N3O5S2/c25-24(26)20-9-8-17(15-21(20)30-16-18-5-4-14-29-18)22-10-12-23(13-11-22)31(27,28)19-6-2-1-3-7-19/h1-9,14-15H,10-13,16H2
InChIKey BPLWLLSVYJCTGH-UHFFFAOYSA-N
Mol Weight 459.54 g/mol
Molecular Formula C21H21N3O5S2
Exact Mass 459.092263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DAi9ogwO9Iw
Name 1-{3-[(2-furylmethyl)sulfanyl]-4-nitrophenyl}-4-(phenylsulfonyl)piperazine
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/C21H21N3O5S2/c25-24(26)20-9-8-17(15-21(20)30-16-18-5-4-14-29-18)22-10-12-23(13-11-22)31(27,28)19-6-2-1-3-7-19/h1-9,14-15H,10-13,16H2
InChIKey BPLWLLSVYJCTGH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5939
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: NMR/11241401; Labnumber: LP-2501852; IOH_ID: IOH-005940
Synonyms 2-furylmethyl 2-nitro-5-[4-(phenylsulfonyl)-1-piperazinyl]phenyl sulfide