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N-[2-(3,4-DIHYDROXYPHENYL)-4-OXOTHIAZOLIDIN-3-YL]-2-(4-METHYL-2-OXO-2H-CHROMEN-7-YLOXY)-ACETAMIDE
SpectraBase Compound ID 7JuRlhA8iXQ
InChI InChI=1S/C21H18N2O7S/c1-11-6-20(28)30-17-8-13(3-4-14(11)17)29-9-18(26)22-23-19(27)10-31-21(23)12-2-5-15(24)16(25)7-12/h2-8,21,24-25H,9-10H2,1H3,(H,22,26)
InChIKey XEQHZHLEDXZGNN-UHFFFAOYSA-N
Mol Weight 442.44 g/mol
Molecular Formula C21H18N2O7S
Exact Mass 442.083472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6a6OfpPovaE
Name N-[2-(3,4-DIHYDROXYPHENYL)-4-OXOTHIAZOLIDIN-3-YL]-2-(4-METHYL-2-OXO-2H-CHROMEN-7-YLOXY)-ACETAMIDE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18N2O7S
InChI InChI=1S/C21H18N2O7S/c1-11-6-20(28)30-17-8-13(3-4-14(11)17)29-9-18(26)22-23-19(27)10-31-21(23)12-2-5-15(24)16(25)7-12/h2-8,21,24-25H,9-10H2,1H3,(H,22,26)
InChIKey XEQHZHLEDXZGNN-UHFFFAOYSA-N
Literature Reference Author M.CACIC,M.MOLNAR,B.SARKANJ,E.HAS-SCHOEN,V.RAJKOVIC
Literature Reference Citation MOLECULES,15,6795(2010)
Literature Reference DOI 10.3390/molecules15106795
Molecular Weight 442.443 g/mol
Sample ID 72484
Solvent DMSO-D6