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2-{5-[4-(benzylsulfonyl)-1-piperazinyl]-2-nitrophenyl}-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID 6GBKkengzPC
InChI InChI=1S/C26H28N4O4S/c31-30(32)25-11-10-24(18-26(25)28-13-12-22-8-4-5-9-23(22)19-28)27-14-16-29(17-15-27)35(33,34)20-21-6-2-1-3-7-21/h1-11,18H,12-17,19-20H2
InChIKey CGRZVYAAQSUNEW-UHFFFAOYSA-N
Mol Weight 492.59 g/mol
Molecular Formula C26H28N4O4S
Exact Mass 492.183127 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7phCyTQAYwM
Name 2-{5-[4-(benzylsulfonyl)-1-piperazinyl]-2-nitrophenyl}-1,2,3,4-tetrahydroisoquinoline
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/C26H28N4O4S/c31-30(32)25-11-10-24(18-26(25)28-13-12-22-8-4-5-9-23(22)19-28)27-14-16-29(17-15-27)35(33,34)20-21-6-2-1-3-7-21/h1-11,18H,12-17,19-20H2
InChIKey CGRZVYAAQSUNEW-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6235
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/11242624; Labnumber: LP-2501877; IOH_ID: IOH-006236