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(5E)-1-butyl-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 7Kp3s17MqXr
InChI InChI=1S/C17H20FN3O3/c1-3-4-9-21-16(23)14(15(22)20-17(21)24)11(2)19-10-12-5-7-13(18)8-6-12/h5-8,19H,3-4,9-10H2,1-2H3,(H,20,22,24)/b14-11+
InChIKey KGGHRQXGPHAONW-SDNWHVSQSA-N
Mol Weight 333.36 g/mol
Molecular Formula C17H20FN3O3
Exact Mass 333.14887 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LNG9gtlVsuz
Name (5E)-1-butyl-5-{1-[(4-fluorobenzyl)amino]ethylidene}-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/C17H20FN3O3/c1-3-4-9-21-16(23)14(15(22)20-17(21)24)11(2)19-10-12-5-7-13(18)8-6-12/h5-8,19H,3-4,9-10H2,1-2H3,(H,20,22,24)/b14-11+
InChIKey KGGHRQXGPHAONW-SDNWHVSQSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4688
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: E10223; Labnumber: KKA-0212A-0172; SBI_ID: SBI-004690
Synonyms 1-butyl-5-{1-[(4-fluorobenzyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 308 °C