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(5Z)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-{[(3,3-diphenylpropyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID CK3qycNzyXu
InChI InChI=1S/C28H31N3O2S/c32-26-25(27(33)31(28(34)30-26)19-17-21-10-4-1-5-11-21)20-29-18-16-24(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h2-3,6-10,12-15,20,24,29H,1,4-5,11,16-19H2,(H,30,32,34)/b25-20-
InChIKey KUIYBVKIRXGJMS-QQTULTPQSA-N
Mol Weight 473.64 g/mol
Molecular Formula C28H31N3O2S
Exact Mass 473.213698 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ILc5rkX8V9F
Name (5Z)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-{[(3,3-diphenylpropyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C28H31N3O2S/c32-26-25(27(33)31(28(34)30-26)19-17-21-10-4-1-5-11-21)20-29-18-16-24(22-12-6-2-7-13-22)23-14-8-3-9-15-23/h2-3,6-10,12-15,20,24,29H,1,4-5,11,16-19H2,(H,30,32,34)/b25-20-
InChIKey KUIYBVKIRXGJMS-QQTULTPQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27581
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: D77185; Labnumber: KKA-0212C-0568; SBI_ID: SBI-027585
Synonyms 1-[2-(1-cyclohexen-1-yl)ethyl]-5-{[(3,3-diphenylpropyl)amino]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 315 °C