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ethyl 4-{5-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoate
SpectraBase Compound ID KZVr0HBGsVb
InChI InChI=1S/C20H18N2O5S/c1-4-26-19(25)13-7-5-12(6-8-13)16-10-9-14(27-16)11-15-17(23)21(2)20(28)22(3)18(15)24/h5-11H,4H2,1-3H3
InChIKey PVSCQFLWHYTJNR-UHFFFAOYSA-N
Mol Weight 398.43 g/mol
Molecular Formula C20H18N2O5S
Exact Mass 398.093643 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GrbHAqQeVQj
Name ethyl 4-{5-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoate
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/C20H18N2O5S/c1-4-26-19(25)13-7-5-12(6-8-13)16-10-9-14(27-16)11-15-17(23)21(2)20(28)22(3)18(15)24/h5-11H,4H2,1-3H3
InChIKey PVSCQFLWHYTJNR-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8350
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: 9685835; UBI_ID: UBI-008353
Temperature 308 °C