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{4-[(E)-(1-(4-fluorobenzyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetic acid
SpectraBase Compound ID 93gzvnXoy71
InChI InChI=1S/C20H15FN2O6/c21-14-5-1-13(2-6-14)10-23-19(27)16(18(26)22-20(23)28)9-12-3-7-15(8-4-12)29-11-17(24)25/h1-9H,10-11H2,(H,24,25)(H,22,26,28)/b16-9+
InChIKey ZVCDHOBXFQKLIZ-CXUHLZMHSA-N
Mol Weight 398.35 g/mol
Molecular Formula C20H15FN2O6
Exact Mass 398.091414 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GrkVzTWguPZ
Name {4-[(E)-(1-(4-fluorobenzyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}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/C20H15FN2O6/c21-14-5-1-13(2-6-14)10-23-19(27)16(18(26)22-20(23)28)9-12-3-7-15(8-4-12)29-11-17(24)25/h1-9H,10-11H2,(H,24,25)(H,22,26,28)/b16-9+
InChIKey ZVCDHOBXFQKLIZ-CXUHLZMHSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7088
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: 124033; Labnumber: KKA001-0001403; VK_ID: VK-007092
Synonyms {4-[(1-(4-fluorobenzyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetic acid
Temperature 308 °C