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4(3H)-pyrimidinone, 2-[4-(phenylmethyl)-1-piperazinyl]-6-[(2-pyrimidinylthio)methyl]-
SpectraBase Compound ID 3fBhYRqUNAv
InChI InChI=1S/C20H22N6OS/c27-18-13-17(15-28-20-21-7-4-8-22-20)23-19(24-18)26-11-9-25(10-12-26)14-16-5-2-1-3-6-16/h1-8,13H,9-12,14-15H2,(H,23,24,27)
InChIKey YZZYESKDBSLSIJ-UHFFFAOYSA-N
Mol Weight 394.5 g/mol
Molecular Formula C20H22N6OS
Exact Mass 394.157581 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A3cvSvsrDKH
Name 4(3H)-pyrimidinone, 2-[4-(phenylmethyl)-1-piperazinyl]-6-[(2-pyrimidinylthio)methyl]-
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/C20H22N6OS/c27-18-13-17(15-28-20-21-7-4-8-22-20)23-19(24-18)26-11-9-25(10-12-26)14-16-5-2-1-3-6-16/h1-8,13H,9-12,14-15H2,(H,23,24,27)
InChIKey YZZYESKDBSLSIJ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4183
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: F20085; Labnumber: VGU-106589