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1-[4-(4-benzhydryl-1-piperazinyl)-6-methyl-1-phenyl-2-thioxo-1,2-dihydro-5-pyrimidinyl]ethanone
SpectraBase Compound ID FL8y4viYfwl
InChI InChI=1S/C30H30N4OS/c1-22-27(23(2)35)29(31-30(36)34(22)26-16-10-5-11-17-26)33-20-18-32(19-21-33)28(24-12-6-3-7-13-24)25-14-8-4-9-15-25/h3-17,28H,18-21H2,1-2H3
InChIKey IVIODAUVINCUDG-UHFFFAOYSA-N
Mol Weight 494.66 g/mol
Molecular Formula C30H30N4OS
Exact Mass 494.214033 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ILO0UyR7cS7
Name 1-[4-(4-benzhydryl-1-piperazinyl)-6-methyl-1-phenyl-2-thioxo-1,2-dihydro-5-pyrimidinyl]ethanone
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/C30H30N4OS/c1-22-27(23(2)35)29(31-30(36)34(22)26-16-10-5-11-17-26)33-20-18-32(19-21-33)28(24-12-6-3-7-13-24)25-14-8-4-9-15-25/h3-17,28H,18-21H2,1-2H3
InChIKey IVIODAUVINCUDG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_7022
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: 9069262; UBI_ID: UBI-007025
Temperature 308 °C