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4-{5-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
SpectraBase Compound ID Kyttwmcjnxw
InChI InChI=1S/C18H14N2O5S/c1-19-15(21)13(16(22)20(2)18(19)26)9-12-7-8-14(25-12)10-3-5-11(6-4-10)17(23)24/h3-9H,1-2H3,(H,23,24)
InChIKey TUSKTCATRCQJIX-UHFFFAOYSA-N
Mol Weight 370.38 g/mol
Molecular Formula C18H14N2O5S
Exact Mass 370.062343 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HjwsjFykSln
Name 4-{5-[(1,3-dimethyl-4,6-dioxo-2-thioxotetrahydro-5(2H)-pyrimidinylidene)methyl]-2-furyl}benzoic acid
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/C18H14N2O5S/c1-19-15(21)13(16(22)20(2)18(19)26)9-12-7-8-14(25-12)10-3-5-11(6-4-10)17(23)24/h3-9H,1-2H3,(H,23,24)
InChIKey TUSKTCATRCQJIX-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8351
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: 9686174; UBI_ID: UBI-008354
Temperature 308 °C