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3-(2'-HYDROXY-2',2'-DIOXO-2'-LAMBDA(6)-DISULFANYL)-2,2-DIMETHYL-2,3,4,10-TETRAHYDRO-2H-PYRANO-[2,3-B]-QUINOLIN-5-ONE
SpectraBase Compound ID IkRb70WyEQu
InChI InChI=1S/C14H15NO5S2/c1-14(2)11(21-22(17,18)19)7-9-12(16)8-5-3-4-6-10(8)15-13(9)20-14/h3-6,11H,7H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKey NDKJUBPMNXDYQI-UHFFFAOYSA-N
Mol Weight 341.4 g/mol
Molecular Formula C14H15NO5S2
Exact Mass 341.039165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwiHyi58yEE
Name 3-(2'-HYDROXY-2',2'-DIOXO-2'-LAMBDA(6)-DISULFANYL)-2,2-DIMETHYL-2,3,4,10-TETRAHYDRO-2H-PYRANO-[2,3-B]-QUINOLIN-5-ONE
Compound Number 5F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H15NO5S2
InChI InChI=1S/C14H15NO5S2/c1-14(2)11(21-22(17,18)19)7-9-12(16)8-5-3-4-6-10(8)15-13(9)20-14/h3-6,11H,7H2,1-2H3,(H,15,16)(H,17,18,19)
InChIKey NDKJUBPMNXDYQI-UHFFFAOYSA-N
Literature Reference Author I.BUTENSCHOEN,K.MOELLER,W.HAENSEL
Literature Reference Citation J.MED.CHEM.,44,1249(2001)
Literature Reference DOI 10.1021/jm001007u
Molecular Weight 341.397 g/mol
Sample ID 44445
Solvent DMSO-D6