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1-(4-[2-[3-([3-[2-(4-(ACETYLPHENYL)-1-DIAZENYL]-1,3-DIAZEPAN-1-YL]-METHYL)-1,3-DIAZEPAN-1-YL]-1-DIAZENYL]-PHENYL)-1-ETHANONE
SpectraBase Compound ID B1BD1H1Xgxh
InChI InChI=1S/C27H36N8O2/c1-22(36)24-7-11-26(12-8-24)28-30-34-17-5-3-15-32(20-34)19-33-16-4-6-18-35(21-33)31-29-27-13-9-25(10-14-27)23(2)37/h7-14H,3-6,15-21H2,1-2H3/b30-28+,31-29+
InChIKey QFOMWOIEDUJNMY-FUEWEDNTSA-N
Mol Weight 504.6 g/mol
Molecular Formula C27H36N8O2
Exact Mass 504.296122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID uZxdkd4S2h
Name 1-(4-[2-[3-([3-[2-(4-(ACETYLPHENYL)-1-DIAZENYL]-1,3-DIAZEPAN-1-YL]-METHYL)-1,3-DIAZEPAN-1-YL]-1-DIAZENYL]-PHENYL)-1-ETHANONE
Compound Number 8E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H36N8O2
InChI InChI=1S/C27H36N8O2/c1-22(36)24-7-11-26(12-8-24)28-30-34-17-5-3-15-32(20-34)19-33-16-4-6-18-35(21-33)31-29-27-13-9-25(10-14-27)23(2)37/h7-14H,3-6,15-21H2,1-2H3/b30-28+,31-29+
InChIKey QFOMWOIEDUJNMY-FUEWEDNTSA-N
Literature Reference Author R.TINGLEY,K.VAUGHAN
Literature Reference Citation CAN.J.CHEM.,84,1434(2006)
Literature Reference DOI 10.1139/v06-123
Molecular Weight 504.635 g/mol
Sample ID 46819
Solvent CDCl3