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(5-bromo-4-{5-[(4-fluoroanilino)carbonyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-4-pyrimidinyl}-2-methoxyphenoxy)acetic acid
SpectraBase Compound ID HQkEPPSDArp
InChI InChI=1S/C21H19BrFN3O6/c1-10-18(20(29)25-12-5-3-11(23)4-6-12)19(26-21(30)24-10)13-7-15(31-2)16(8-14(13)22)32-9-17(27)28/h3-8,19H,9H2,1-2H3,(H,25,29)(H,27,28)(H2,24,26,30)
InChIKey ZNUFQSVYHVTDNX-UHFFFAOYSA-N
Mol Weight 508.3 g/mol
Molecular Formula C21H19BrFN3O6
Exact Mass 507.044127 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E5Bl919IEgf
Name (5-bromo-4-{5-[(4-fluoroanilino)carbonyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-4-pyrimidinyl}-2-methoxyphenoxy)acetic acid
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/C21H19BrFN3O6/c1-10-18(20(29)25-12-5-3-11(23)4-6-12)19(26-21(30)24-10)13-7-15(31-2)16(8-14(13)22)32-9-17(27)28/h3-8,19H,9H2,1-2H3,(H,25,29)(H,27,28)(H2,24,26,30)
InChIKey ZNUFQSVYHVTDNX-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_31628
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: 1843121; SBI_ID: SBI-031632
Temperature 306 °C