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(5Z)-1-(3,4-dimethylphenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione

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(5Z)-1-(3,4-dimethylphenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID CFdCXXcOUT0
InChI InChI=1S/C25H22FN3O3/c1-14-5-8-21(11-15(14)2)29-24(31)22(23(30)27-25(29)32)13-18-12-16(3)28(17(18)4)20-9-6-19(26)7-10-20/h5-13H,1-4H3,(H,27,30,32)/b22-13-
InChIKey GACJHUPBKZNYDA-XKZIYDEJSA-N
Mol Weight 431.47 g/mol
Molecular Formula C25H22FN3O3
Exact Mass 431.16452 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LjyBXVDkXUk
Name (5Z)-1-(3,4-dimethylphenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C25H22FN3O3/c1-14-5-8-21(11-15(14)2)29-24(31)22(23(30)27-25(29)32)13-18-12-16(3)28(17(18)4)20-9-6-19(26)7-10-20/h5-13H,1-4H3,(H,27,30,32)/b22-13-
InChIKey GACJHUPBKZNYDA-XKZIYDEJSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3745
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: D93756; Labnumber: KKA-0212B-0645; SBI_ID: SBI-003747
Synonyms 1-(3,4-dimethylphenyl)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 315 °C