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N-[(5,5A,7,9,13B,13C-HEXAHYDRO-5,9-DIOXO-7-PHENYLDIINDENO-[2,1-D:1',2'-F]-[1,2]-OXAZEPIN-5A-YL)-METHYLENE]-PHENYLAMINE-N-OXIDE

View entire compound with spectra: 1 NMR

N-[(5,5A,7,9,13B,13C-HEXAHYDRO-5,9-DIOXO-7-PHENYLDIINDENO-[2,1-D:1',2'-F]-[1,2]-OXAZEPIN-5A-YL)-METHYLENE]-PHENYLAMINE-N-OXIDE
SpectraBase Compound ID FY6S4is7VCq
InChI InChI=1S/C32H22N2O4/c35-30-25-17-9-7-15-23(25)28-27(30)19-34(22-13-5-2-6-14-22)38-32(20-33(37)21-11-3-1-4-12-21)29(28)24-16-8-10-18-26(24)31(32)36/h1-20,28-29H/b33-20-
InChIKey DUHUGRKUUNKOEX-UCMJSZAQSA-N
Mol Weight 498.5 g/mol
Molecular Formula C32H22N2O4
Exact Mass 498.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5xq37CpoHir
Name N-[(5,5A,7,9,13B,13C-HEXAHYDRO-5,9-DIOXO-7-PHENYLDIINDENO-[2,1-D:1',2'-F]-[1,2]-OXAZEPIN-5A-YL)-METHYLENE]-PHENYLAMINE-N-OXIDE
CAS Registry Number 122901-76-2
Compound Number 12D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H22N2O4
InChI InChI=1S/C32H22N2O4/c35-30-25-17-9-7-15-23(25)28-27(30)19-34(22-13-5-2-6-14-22)38-32(20-33(37)21-11-3-1-4-12-21)29(28)24-16-8-10-18-26(24)31(32)36/h1-20,28-29H/b33-20-
InChIKey DUHUGRKUUNKOEX-UCMJSZAQSA-N
Literature Reference Author H.G.AURICH,M.FRANZKE,H.P.KESSELHEIM,W.KESSLER,W.MASSA,S.WOCA DLO
Literature Reference Citation CHEM.BER.,123,513(1990)
Literature Reference DOI 10.1002/cber.19901230318
Molecular Weight 498.538 g/mol
Solvent CDCl3
Source File Reference UWCS17075