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1-(1,3-benzodioxol-5-ylmethyl)-4-(2-thienylcarbonyl)piperazin-1-ium chloride

View entire compound with spectra: 1 NMR

1-(1,3-benzodioxol-5-ylmethyl)-4-(2-thienylcarbonyl)piperazin-1-ium chloride
SpectraBase Compound ID N0NjBFAjec
InChI InChI=1S/C17H18N2O3S.ClH/c20-17(16-2-1-9-23-16)19-7-5-18(6-8-19)11-13-3-4-14-15(10-13)22-12-21-14;/h1-4,9-10H,5-8,11-12H2;1H
InChIKey YOKLABUZILBFGG-UHFFFAOYSA-N
Mol Weight 366.86 g/mol
Molecular Formula C17H19ClN2O3S
Exact Mass 366.080491 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5hDi3MbpmBA
Name 1-(1,3-benzodioxol-5-ylmethyl)-4-(2-thienylcarbonyl)piperazin-1-ium chloride
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C17H18N2O3S.ClH/c20-17(16-2-1-9-23-16)19-7-5-18(6-8-19)11-13-3-4-14-15(10-13)22-12-21-14;/h1-4,9-10H,5-8,11-12H2;1H
InChIKey YOKLABUZILBFGG-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_2430
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: 111538; Labnumber: EX00111928; VK_ID: VK-002431
Temperature 318 °C