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

*Links on SpectraBase are not permalinks.
1-[(3-chloro-6-methyl-1-benzothien-2-yl)carbonyl]-4-(2-methoxyphenyl)piperazine
SpectraBase Compound ID EEmLmubqa7T
InChI InChI=1S/C21H21ClN2O2S/c1-14-7-8-15-18(13-14)27-20(19(15)22)21(25)24-11-9-23(10-12-24)16-5-3-4-6-17(16)26-2/h3-8,13H,9-12H2,1-2H3
InChIKey CJCKRLVKVCUTSQ-UHFFFAOYSA-N
Mol Weight 400.92 g/mol
Molecular Formula C21H21ClN2O2S
Exact Mass 400.101227 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 IfapmhBWyMC
Name 1-[(3-chloro-6-methyl-1-benzothien-2-yl)carbonyl]-4-(2-methoxyphenyl)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/C21H21ClN2O2S/c1-14-7-8-15-18(13-14)27-20(19(15)22)21(25)24-11-9-23(10-12-24)16-5-3-4-6-17(16)26-2/h3-8,13H,9-12H2,1-2H3
InChIKey CJCKRLVKVCUTSQ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_12960
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/8045549; Labnumber: NSB0017768; UZI_ID: UZI-012964
Synonyms 2-{4-[(3-chloro-6-methyl-1-benzothien-2-yl)carbonyl]-1-piperazinyl}phenyl methyl ether
Temperature 318 °C