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3-{[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}benzoic acid
SpectraBase Compound ID 9hG1NIideXF
InChI InChI=1S/C19H15N3O5/c1-11-5-7-14(8-6-11)22-17(24)15(16(23)21-19(22)27)10-20-13-4-2-3-12(9-13)18(25)26/h2-10,20H,1H3,(H,25,26)(H,21,23,27)/b15-10-
InChIKey HKWBSNIFOIASSE-GDNBJRDFSA-N
Mol Weight 365.35 g/mol
Molecular Formula C19H15N3O5
Exact Mass 365.101171 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3PXJoUKOk7j
Name 3-{[(Z)-(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}benzoic 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/C19H15N3O5/c1-11-5-7-14(8-6-11)22-17(24)15(16(23)21-19(22)27)10-20-13-4-2-3-12(9-13)18(25)26/h2-10,20H,1H3,(H,25,26)(H,21,23,27)/b15-10-
InChIKey HKWBSNIFOIASSE-GDNBJRDFSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_5166
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: UZI/8061248; Labnumber: BMW-96946T; UZI_ID: UZI-005168
Synonyms 3-{[(1-(4-methylphenyl)-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]amino}benzoic acid
Temperature 313 °C