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

*Links on SpectraBase are not permalinks.
1-(4-methoxybenzoyl)-4-[4-(methylsulfanyl)benzyl]piperazin-4-ium
SpectraBase Compound ID 3etPkkFbVNj
InChI InChI=1S/C20H24N2O2S/c1-24-18-7-5-17(6-8-18)20(23)22-13-11-21(12-14-22)15-16-3-9-19(25-2)10-4-16/h3-10H,11-15H2,1-2H3/p+1
InChIKey OXUKLCDUDCDTQD-UHFFFAOYSA-O
Mol Weight 357.49 g/mol
Molecular Formula C20H25N2O2S
Exact Mass 357.163674 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 4i6mt0XagrS
Name 1-(4-methoxybenzoyl)-4-[4-(methylsulfanyl)benzyl]piperazin-4-ium
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/C20H24N2O2S/c1-24-18-7-5-17(6-8-18)20(23)22-13-11-21(12-14-22)15-16-3-9-19(25-2)10-4-16/h3-10H,11-15H2,1-2H3/p+1
InChIKey OXUKLCDUDCDTQD-UHFFFAOYSA-O
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13769
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/9312050; UBI_ID: UBI-013772
Temperature 308 °C