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4,6(1H,5H)-pyrimidinedione, 1,3-diethyldihydro-5-[[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylene]-2-thioxo-
SpectraBase Compound ID 6BaJwju6Pzq
InChI InChI=1S/C19H18N4O4S/c1-3-20-17(24)16(18(25)21(4-2)19(20)28)12-15-6-5-11-22(15)13-7-9-14(10-8-13)23(26)27/h5-12H,3-4H2,1-2H3
InChIKey YFLNINULKXAIPG-UHFFFAOYSA-N
Mol Weight 398.44 g/mol
Molecular Formula C19H18N4O4S
Exact Mass 398.104876 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fg6vo78rwn8
Name 4,6(1H,5H)-pyrimidinedione, 1,3-diethyldihydro-5-[[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylene]-2-thioxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.104876246 u
Formula C19H18N4O4S
InChI InChI=1S/C19H18N4O4S/c1-3-20-17(24)16(18(25)21(4-2)19(20)28)12-15-6-5-11-22(15)13-7-9-14(10-8-13)23(26)27/h5-12H,3-4H2,1-2H3
InChIKey YFLNINULKXAIPG-UHFFFAOYSA-N
Molecular Weight 398.437 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7328
Solvent DMSO-d6
Source Vendor ID: NMR/10222962; Lab Info: SAD; Lab Number: SAD-DAS1600
Temperature 29.85 °C