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

View entire compound with spectra: 1 NMR

4-(1,3-benzodioxol-5-ylmethyl)-N-(4-methoxyphenyl)-1-piperazinecarbothioamide
SpectraBase Compound ID GvkRDNUZCi9
InChI InChI=1S/C20H23N3O3S/c1-24-17-5-3-16(4-6-17)21-20(27)23-10-8-22(9-11-23)13-15-2-7-18-19(12-15)26-14-25-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,27)
InChIKey BYXNPOPSBKAYPV-UHFFFAOYSA-N
Mol Weight 385.48 g/mol
Molecular Formula C20H23N3O3S
Exact Mass 385.146013 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7XIxjsu7RBk
Name 4-(1,3-benzodioxol-5-ylmethyl)-N-(4-methoxyphenyl)-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/C20H23N3O3S/c1-24-17-5-3-16(4-6-17)21-20(27)23-10-8-22(9-11-23)13-15-2-7-18-19(12-15)26-14-25-18/h2-7,12H,8-11,13-14H2,1H3,(H,21,27)
InChIKey BYXNPOPSBKAYPV-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_10520
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: 1003663; UBI_ID: UBI-010523
Temperature 313 °C