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ethyl 4-amino-2-{[1-(3-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl]sulfanyl}-5-pyrimidinecarboxylate
SpectraBase Compound ID DcKGGplLUpQ
InChI InChI=1S/C17H15FN4O4S/c1-2-26-16(25)11-8-20-17(21-14(11)19)27-12-7-13(23)22(15(12)24)10-5-3-4-9(18)6-10/h3-6,8,12H,2,7H2,1H3,(H2,19,20,21)
InChIKey KNFLMKKIDZQTGQ-UHFFFAOYSA-N
Mol Weight 390.39 g/mol
Molecular Formula C17H15FN4O4S
Exact Mass 390.079804 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7VfMUoAvnMv
Name ethyl 4-amino-2-{[1-(3-fluorophenyl)-2,5-dioxo-3-pyrrolidinyl]sulfanyl}-5-pyrimidinecarboxylate
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/C17H15FN4O4S/c1-2-26-16(25)11-8-20-17(21-14(11)19)27-12-7-13(23)22(15(12)24)10-5-3-4-9(18)6-10/h3-6,8,12H,2,7H2,1H3,(H2,19,20,21)
InChIKey KNFLMKKIDZQTGQ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28619
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: D86424; Labnumber: VGU-30471; SBI_ID: SBI-028623
Temperature 303 °C