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1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-bromophenyl)sulfonyl]piperazine
SpectraBase Compound ID CHGfj9RCMKC
InChI InChI=1S/C18H19BrN2O4S/c19-15-2-4-16(5-3-15)26(22,23)21-9-7-20(8-10-21)12-14-1-6-17-18(11-14)25-13-24-17/h1-6,11H,7-10,12-13H2
InChIKey LIUBBTLNNWTSRH-UHFFFAOYSA-N
Mol Weight 439.32 g/mol
Molecular Formula C18H19BrN2O4S
Exact Mass 438.024891 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JJKtMO6Z8bH
Name 1-(1,3-benzodioxol-5-ylmethyl)-4-[(4-bromophenyl)sulfonyl]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/C18H19BrN2O4S/c19-15-2-4-16(5-3-15)26(22,23)21-9-7-20(8-10-21)12-14-1-6-17-18(11-14)25-13-24-17/h1-6,11H,7-10,12-13H2
InChIKey LIUBBTLNNWTSRH-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5121
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: 114812; Labnumber: SERK1-20934; VK_ID: VK-005124
Temperature 308 °C