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2-((E)-2-{2,5-dimethyl-1-[4-(4-morpholinyl)phenyl]-1H-pyrrol-3-yl}ethenyl)-6-hydroxy-5-nitro-4(3H)-pyrimidinone
SpectraBase Compound ID AsO0VAcr6f2
InChI InChI=1S/C22H23N5O5/c1-14-13-16(3-8-19-23-21(28)20(27(30)31)22(29)24-19)15(2)26(14)18-6-4-17(5-7-18)25-9-11-32-12-10-25/h3-8,13H,9-12H2,1-2H3,(H2,23,24,28,29)/b8-3+
InChIKey OIMQNDRZOOGJLX-FPYGCLRLSA-N
Mol Weight 437.46 g/mol
Molecular Formula C22H23N5O5
Exact Mass 437.169919 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lht6u8TzjaS
Name 2-((E)-2-{2,5-dimethyl-1-[4-(4-morpholinyl)phenyl]-1H-pyrrol-3-yl}ethenyl)-6-hydroxy-5-nitro-4(3H)-pyrimidinone
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/C22H23N5O5/c1-14-13-16(3-8-19-23-21(28)20(27(30)31)22(29)24-19)15(2)26(14)18-6-4-17(5-7-18)25-9-11-32-12-10-25/h3-8,13H,9-12H2,1-2H3,(H2,23,24,28,29)/b8-3+
InChIKey OIMQNDRZOOGJLX-FPYGCLRLSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35039
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: E83290; SBI_ID: SBI-035043
Synonyms 2-(2-{2,5-dimethyl-1-[4-(4-morpholinyl)phenyl]-1H-pyrrol-3-yl}ethenyl)-6-hydroxy-5-nitro-4(3H)-pyrimidinone
Temperature 298 °C