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5-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-methoxyphenyl 4-methylbenzoate
SpectraBase Compound ID DaHA2eoAJDa
InChI InChI=1S/C20H16N2O5S/c1-11-3-6-13(7-4-11)19(25)27-16-10-12(5-8-15(16)26-2)9-14-17(23)21-20(28)22-18(14)24/h3-10H,1-2H3,(H2,21,22,23,24,28)
InChIKey GFGLNZRNRJRRMR-UHFFFAOYSA-N
Mol Weight 396.42 g/mol
Molecular Formula C20H16N2O5S
Exact Mass 396.077993 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D5zl0coaFMW
Name 5-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-methoxyphenyl 4-methylbenzoate
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/C20H16N2O5S/c1-11-3-6-13(7-4-11)19(25)27-16-10-12(5-8-15(16)26-2)9-14-17(23)21-20(28)22-18(14)24/h3-10H,1-2H3,(H2,21,22,23,24,28)
InChIKey GFGLNZRNRJRRMR-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3723
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: UZI/1008125; UBI_ID: UBI-003724
Temperature 308 °C