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(5Z)-5-{[1-(4-bromo-1-naphthyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-cyclohexyl-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 8NiouBzyvT9
InChI InChI=1S/C27H26BrN3O3/c1-16-14-18(17(2)30(16)24-13-12-23(28)20-10-6-7-11-21(20)24)15-22-25(32)29-27(34)31(26(22)33)19-8-4-3-5-9-19/h6-7,10-15,19H,3-5,8-9H2,1-2H3,(H,29,32,34)/b22-15-
InChIKey PRJBBEZMBJBDMA-JCMHNJIXSA-N
Mol Weight 520.43 g/mol
Molecular Formula C27H26BrN3O3
Exact Mass 519.115755 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ySylWgOF69
Name (5Z)-5-{[1-(4-bromo-1-naphthyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-cyclohexyl-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/C27H26BrN3O3/c1-16-14-18(17(2)30(16)24-13-12-23(28)20-10-6-7-11-21(20)24)15-22-25(32)29-27(34)31(26(22)33)19-8-4-3-5-9-19/h6-7,10-15,19H,3-5,8-9H2,1-2H3,(H,29,32,34)/b22-15-
InChIKey PRJBBEZMBJBDMA-JCMHNJIXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15736
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: C75121; Labnumber: SPDEM-2330; SBI_ID: SBI-015739
Synonyms 5-{[1-(4-bromo-1-naphthyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylene}-1-cyclohexyl-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C