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3,8-DI-[2-(ORTHO-NITROPHENYL)-1-AZENYL]-1,3,6,8-TETRAAZABICYCLO-[4.4.1]-UNDECANE
SpectraBase Compound ID 5pgsunc2uJe
InChI InChI=1S/C19H22N10O4/c30-28(31)18-7-3-1-5-16(18)20-22-26-11-9-25-13-24(14-26)10-12-27(15-25)23-21-17-6-2-4-8-19(17)29(32)33/h1-8H,9-15H2/b22-20+,23-21+
InChIKey VHFFRHHBIPGYPZ-DQPVQCHKSA-N
Mol Weight 454.45 g/mol
Molecular Formula C19H22N10O4
Exact Mass 454.182549 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgxcEnn6i9I
Name 3,8-DI-[2-(ORTHO-NITROPHENYL)-1-AZENYL]-1,3,6,8-TETRAAZABICYCLO-[4.4.1]-UNDECANE
Compound Number 6G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22N10O4
InChI InChI=1S/C19H22N10O4/c30-28(31)18-7-3-1-5-16(18)20-22-26-11-9-25-13-24(14-26)10-12-27(15-25)23-21-17-6-2-4-8-19(17)29(32)33/h1-8H,9-15H2/b22-20+,23-21+
InChIKey VHFFRHHBIPGYPZ-DQPVQCHKSA-N
Literature Reference Author M.B.PEORI,K.VAUGHAN,D.L.HOOPER
Literature Reference Citation J.ORG.CHEM.,63,7437(1998)
Literature Reference DOI 10.1021/jo981276g
Molecular Weight 454.448 g/mol
Sample ID 26774
Solvent CDCl3