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2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-nitro-4,6-pyrimidinediol
SpectraBase Compound ID JUerdrN2MO1
InChI InChI=1S/C14H13N3O5/c1-2-22-10-6-3-9(4-7-10)5-8-11-15-13(18)12(17(20)21)14(19)16-11/h3-8H,2H2,1H3,(H2,15,16,18,19)/b8-5+
InChIKey QXTODIVXWYTHGZ-VMPITWQZSA-N
Mol Weight 303.27 g/mol
Molecular Formula C14H13N3O5
Exact Mass 303.085521 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 72V3VnRXJFD
Name 2-[(E)-2-(4-ethoxyphenyl)ethenyl]-5-nitro-4,6-pyrimidinediol
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/C14H13N3O5/c1-2-22-10-6-3-9(4-7-10)5-8-11-15-13(18)12(17(20)21)14(19)16-11/h3-8H,2H2,1H3,(H2,15,16,18,19)/b8-5+
InChIKey QXTODIVXWYTHGZ-VMPITWQZSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_432
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: /VSVE0061973; UBI_ID: UBI-000433
Synonyms 2-[2-(4-ethoxyphenyl)ethenyl]-5-nitro-4,6-pyrimidinediol
Temperature 308 °C