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[[5,5-DIOXO-DIBENZO-[B,E]-THIEPIN-11(6H)-YLIDEN-AMINO]-OXY]-(4-NITROPHENYL)-METHANONE
SpectraBase Compound ID Jj9Ue5gWbhT
InChI InChI=1S/C21H14N2O6S/c24-21(14-9-11-16(12-10-14)23(25)26)29-22-20-17-6-2-1-5-15(17)13-30(27,28)19-8-4-3-7-18(19)20/h1-12H,13H2/b22-20-
InChIKey MSGQNEVOIMWTSP-XDOYNYLZSA-N
Mol Weight 422.41 g/mol
Molecular Formula C21H14N2O6S
Exact Mass 422.057257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4OgUCYsTI9M
Name [[5,5-DIOXO-DIBENZO-[B,E]-THIEPIN-11(6H)-YLIDEN-AMINO]-OXY]-(4-NITROPHENYL)-METHANONE
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H14N2O6S
InChI InChI=1S/C21H14N2O6S/c24-21(14-9-11-16(12-10-14)23(25)26)29-22-20-17-6-2-1-5-15(17)13-30(27,28)19-8-4-3-7-18(19)20/h1-12H,13H2/b22-20-
InChIKey MSGQNEVOIMWTSP-XDOYNYLZSA-N
Literature Reference Author C.E.STECOZA,C.ILIE,C.DRAGHICI,M.T.CAPROIU
Literature Reference Citation FARMACIA,61,378(2013)
Molecular Weight 422.412 g/mol
Source File Reference UWLU76197