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(5E)-1-methyl-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 8TdVkTuh2tC
InChI InChI=1S/C16H12N4O5/c1-18-15(22)13(14(21)17-16(18)23)9-11-6-3-7-19(11)10-4-2-5-12(8-10)20(24)25/h2-9H,1H3,(H,17,21,23)/b13-9+
InChIKey AOLLMUCGNRVSFP-UKTHLTGXSA-N
Mol Weight 340.3 g/mol
Molecular Formula C16H12N4O5
Exact Mass 340.080769 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HG2oGRxzr1
Name (5E)-1-methyl-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
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/C16H12N4O5/c1-18-15(22)13(14(21)17-16(18)23)9-11-6-3-7-19(11)10-4-2-5-12(8-10)20(24)25/h2-9H,1H3,(H,17,21,23)/b13-9+
InChIKey AOLLMUCGNRVSFP-UKTHLTGXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5604
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: D23106; Labnumber: KVEX-30034; SBI_ID: SBI-005606
Synonyms 1-methyl-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylene}-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C