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(5E)-5-[4-(diethylamino)-2-hydroxybenzylidene]-1-[3-(trifluoromethyl)phenyl]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 6Gl0dmGg08R
InChI InChI=1S/C22H20F3N3O4/c1-3-27(4-2)15-9-8-13(18(29)12-15)10-17-19(30)26-21(32)28(20(17)31)16-7-5-6-14(11-16)22(23,24)25/h5-12,29H,3-4H2,1-2H3,(H,26,30,32)/b17-10+
InChIKey IUOXVRZBHDPMIZ-LICLKQGHSA-N
Mol Weight 447.41 g/mol
Molecular Formula C22H20F3N3O4
Exact Mass 447.140591 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 12XYT0a1L9H
Name (5E)-5-[4-(diethylamino)-2-hydroxybenzylidene]-1-[3-(trifluoromethyl)phenyl]-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/C22H20F3N3O4/c1-3-27(4-2)15-9-8-13(18(29)12-15)10-17-19(30)26-21(32)28(20(17)31)16-7-5-6-14(11-16)22(23,24)25/h5-12,29H,3-4H2,1-2H3,(H,26,30,32)/b17-10+
InChIKey IUOXVRZBHDPMIZ-LICLKQGHSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5347
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: NMR/10321770; Labnumber: LP-1708330; IOH_ID: IOH-005348
Synonyms 5-[4-(diethylamino)-2-hydroxybenzylidene]-1-[3-(trifluoromethyl)phenyl]-2,4,6(1H,3H,5H)-pyrimidinetrione