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2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[(5-methyl-3-isoxazolyl)amino]methylene]-1-(2-phenylethyl)-, (5Z)-
SpectraBase Compound ID HoU8fdjEZB5
InChI InChI=1S/C17H16N4O4/c1-11-9-14(20-25-11)18-10-13-15(22)19-17(24)21(16(13)23)8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3,(H,18,20)(H,19,22,24)/b13-10-
InChIKey BPDOBSHNRZYZTI-RAXLEYEMSA-N
Mol Weight 340.34 g/mol
Molecular Formula C17H16N4O4
Exact Mass 340.117155 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9d9Tdt3CUch
Name 2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[(5-methyl-3-isoxazolyl)amino]methylene]-1-(2-phenylethyl)-, (5Z)-
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/C17H16N4O4/c1-11-9-14(20-25-11)18-10-13-15(22)19-17(24)21(16(13)23)8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3,(H,18,20)(H,19,22,24)/b13-10-
InChIKey BPDOBSHNRZYZTI-RAXLEYEMSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_197
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: F03248; Labnumber: KV-05-054-0590