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5-nitro-2-{4-[(2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}benzonitrile
SpectraBase Compound ID BXc4FngJ1TJ
InChI InChI=1S/C18H10N4O6/c19-9-11-8-12(22(26)27)3-6-15(11)28-13-4-1-10(2-5-13)7-14-16(23)20-18(25)21-17(14)24/h1-8H,(H2,20,21,23,24,25)
InChIKey NODDOESQCDDCAK-UHFFFAOYSA-N
Mol Weight 378.3 g/mol
Molecular Formula C18H10N4O6
Exact Mass 378.060034 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3hc9Dv63XWT
Name 5-nitro-2-{4-[(2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}benzonitrile
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/C18H10N4O6/c19-9-11-8-12(22(26)27)3-6-15(11)28-13-4-1-10(2-5-13)7-14-16(23)20-18(25)21-17(14)24/h1-8H,(H2,20,21,23,24,25)
InChIKey NODDOESQCDDCAK-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5179
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: 9685509; UBI_ID: UBI-005181
Temperature 308 °C