For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(1,3-benzodioxol-5-ylmethyl)-4-[(2E)-3-(2,4-dichlorophenyl)-2-propenoyl]piperazine
SpectraBase Compound ID 51PQ91dOMCh
InChI InChI=1S/C21H20Cl2N2O3/c22-17-4-2-16(18(23)12-17)3-6-21(26)25-9-7-24(8-10-25)13-15-1-5-19-20(11-15)28-14-27-19/h1-6,11-12H,7-10,13-14H2/b6-3+
InChIKey DBXFMQNJWDFZCJ-ZZXKWVIFSA-N
Mol Weight 419.31 g/mol
Molecular Formula C21H20Cl2N2O3
Exact Mass 418.085098 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JJQn1lBx3bG
Name 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2E)-3-(2,4-dichlorophenyl)-2-propenoyl]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/C21H20Cl2N2O3/c22-17-4-2-16(18(23)12-17)3-6-21(26)25-9-7-24(8-10-25)13-15-1-5-19-20(11-15)28-14-27-19/h1-6,11-12H,7-10,13-14H2/b6-3+
InChIKey DBXFMQNJWDFZCJ-ZZXKWVIFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16318
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: UZI/8099144; UBI_ID: UBI-016321
Synonyms 1-(1,3-benzodioxol-5-ylmethyl)-4-[3-(2,4-dichlorophenyl)-2-propenoyl]piperazine
Temperature 318 °C