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4-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-methoxyphenyl 4-methoxybenzoate
SpectraBase Compound ID 7nN8MJ03enT
InChI InChI=1S/C20H16N2O6S/c1-26-13-6-4-12(5-7-13)19(25)28-15-8-3-11(10-16(15)27-2)9-14-17(23)21-20(29)22-18(14)24/h3-10H,1-2H3,(H2,21,22,23,24,29)
InChIKey GXONMAISILWXEV-UHFFFAOYSA-N
Mol Weight 412.42 g/mol
Molecular Formula C20H16N2O6S
Exact Mass 412.072907 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5gT5YioBaHY
Name 4-[(4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-methoxyphenyl 4-methoxybenzoate
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/C20H16N2O6S/c1-26-13-6-4-12(5-7-13)19(25)28-15-8-3-11(10-16(15)27-2)9-14-17(23)21-20(29)22-18(14)24/h3-10H,1-2H3,(H2,21,22,23,24,29)
InChIKey GXONMAISILWXEV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4765
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/1008261; UBI_ID: UBI-004766
Temperature 318 °C