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1-(1,3-Benzodioxol-5-ylmethyl)-4-[(2,5-dichlorophenyl)sulfonyl]piperazine
SpectraBase Compound ID LQDpzlCfybE
InChI InChI=1S/C18H18Cl2N2O4S/c19-14-2-3-15(20)18(10-14)27(23,24)22-7-5-21(6-8-22)11-13-1-4-16-17(9-13)26-12-25-16/h1-4,9-10H,5-8,11-12H2
InChIKey YCBMQKZFUNXSMN-UHFFFAOYSA-N
Mol Weight 429.32 g/mol
Molecular Formula C18H18Cl2N2O4S
Exact Mass 428.036434 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8F53K3JgTt5
Name 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2,5-dichlorophenyl)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/C18H18Cl2N2O4S/c19-14-2-3-15(20)18(10-14)27(23,24)22-7-5-21(6-8-22)11-13-1-4-16-17(9-13)26-12-25-16/h1-4,9-10H,5-8,11-12H2
InChIKey YCBMQKZFUNXSMN-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5097
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: 114788; Labnumber: SERK1-20745; VK_ID: VK-005100
Temperature 308 °C