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4-(1,3-benzodioxol-5-ylmethyl)-N-(4-chlorophenyl)-1-piperazinecarbothioamide

View entire compound with spectra: 1 NMR

4-(1,3-benzodioxol-5-ylmethyl)-N-(4-chlorophenyl)-1-piperazinecarbothioamide
SpectraBase Compound ID 8p29eUP6319
InChI InChI=1S/C19H20ClN3O2S/c20-15-2-4-16(5-3-15)21-19(26)23-9-7-22(8-10-23)12-14-1-6-17-18(11-14)25-13-24-17/h1-6,11H,7-10,12-13H2,(H,21,26)
InChIKey JUSGHZGSDCNUAZ-UHFFFAOYSA-N
Mol Weight 389.9 g/mol
Molecular Formula C19H20ClN3O2S
Exact Mass 389.096476 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fn3DHpAshpp
Name 4-(1,3-benzodioxol-5-ylmethyl)-N-(4-chlorophenyl)-1-piperazinecarbothioamide
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/C19H20ClN3O2S/c20-15-2-4-16(5-3-15)21-19(26)23-9-7-22(8-10-23)12-14-1-6-17-18(11-14)25-13-24-17/h1-6,11H,7-10,12-13H2,(H,21,26)
InChIKey JUSGHZGSDCNUAZ-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10532
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: 1003470; UBI_ID: UBI-010535
Temperature 313 °C