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2-METHYL-DIBENZO-[B,E]-OXEPIN-11(6H)-ONE-O-(2-NITRO-BENZOYL)-OXIME;MAJOR-ISOMER
SpectraBase Compound ID 51UZwW3kMFm
InChI InChI=1S/C22H16N2O5/c1-14-10-11-20-18(12-14)21(16-7-3-2-6-15(16)13-28-20)23-29-22(25)17-8-4-5-9-19(17)24(26)27/h2-12H,13H2,1H3/b23-21+
InChIKey GWWMWPBZPDWBSW-XTQSDGFTSA-N
Mol Weight 388.38 g/mol
Molecular Formula C22H16N2O5
Exact Mass 388.105922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsIOyRI2lN8
Name 2-METHYL-DIBENZO-[B,E]-OXEPIN-11(6H)-ONE-O-(2-NITRO-BENZOYL)-OXIME;MINOR-ISOMER
Compound Number 6E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H16N2O5
InChI InChI=1S/C22H16N2O5/c1-14-10-11-20-18(12-14)21(16-7-3-2-6-15(16)13-28-20)23-29-22(25)17-8-4-5-9-19(17)24(26)27/h2-12H,13H2,1H3/b23-21+
InChIKey GWWMWPBZPDWBSW-XTQSDGFTSA-N
Literature Reference Author B.SADEK,C.LIMBAN,C.E.STECOZA,S.ELZ
Literature Reference Citation SCI.PHARM.,79,749(2011)
Literature Reference DOI 10.3797/scipharm.1107-02
Molecular Weight 388.379 g/mol
Sample ID 3053
Solvent CDCl3