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ETHYL-9-(FURAN-2-YL)-7-METHYL-2,4-DITHIOXO-2,3,4,9-TETRAHYDRO-1H-THIAZOLO-[3,2-A:4,5-D']-DIPYRIMIDINE-8-CARBOXYLATE
SpectraBase Compound ID DpSFH4hMlmL
InChI InChI=1S/C16H14N4O3S3/c1-3-22-14(21)9-7(2)17-16-20(10(9)8-5-4-6-23-8)12-11(26-16)13(24)19-15(25)18-12/h4-6,10H,3H2,1-2H3,(H2,18,19,24,25)
InChIKey IBCVVMLXOGANIG-UHFFFAOYSA-N
Mol Weight 406.49 g/mol
Molecular Formula C16H14N4O3S3
Exact Mass 406.022804 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 35fJNL1tHCf
Name ETHYL-9-(FURAN-2-YL)-7-METHYL-2,4-DITHIOXO-2,3,4,9-TETRAHYDRO-1H-THIAZOLO-[3,2-A:4,5-D']-DIPYRIMIDINE-8-CARBOXYLATE
Compound Number 5D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H14N4O3S3
InChI InChI=1S/C16H14N4O3S3/c1-3-22-14(21)9-7(2)17-16-20(10(9)8-5-4-6-23-8)12-11(26-16)13(24)19-15(25)18-12/h4-6,10H,3H2,1-2H3,(H2,18,19,24,25)
InChIKey IBCVVMLXOGANIG-UHFFFAOYSA-N
Literature Reference Author M.M.YOUSSEF,M.A.AMIN
Literature Reference Citation MOLECULES,17,9652(2012)
Literature Reference DOI 10.3390/molecules17089652
Molecular Weight 406.492 g/mol
Sample ID 1394
Solvent DMSO-D6