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5-(2,3-dimethoxybenzylidene)-2-thiobarbituric acid
SpectraBase Compound ID 55ln1aRaHVP
InChI InChI=1S/C13H12N2O4S/c1-18-9-5-3-4-7(10(9)19-2)6-8-11(16)14-13(20)15-12(8)17/h3-6H,1-2H3,(H2,14,15,16,17,20)
InChIKey WIILYOCLGCXSFE-UHFFFAOYSA-N
Mol Weight 292.31 g/mol
Molecular Formula C13H12N2O4S
Exact Mass 292.051778 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IiXCy5bk1At
Name 4,6(1H,5H)-pyrimidinedione, 5-[(2,3-dimethoxyphenyl)methylene]dihydro-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 292.051778044 u
Formula C13H12N2O4S
InChI InChI=1S/C13H12N2O4S/c1-18-9-5-3-4-7(10(9)19-2)6-8-11(16)14-13(20)15-12(8)17/h3-6H,1-2H3,(H2,14,15,16,17,20)
InChIKey WIILYOCLGCXSFE-UHFFFAOYSA-N
Molecular Weight 292.309 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_1960
Solvent DMSO-d6
Source Vendor ID: ZI/9010536; Lab Info: LD; Lab Number: LD-6a07707
Temperature 29.85 °C