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1,1'-[4,4'-METHYLENE-BIS-(4,1-PHENYLENE)]-BIS-[4-(ANTHRACEN-9-YL)-3-PHENOXY-AZETIDIN-2-ONE]
SpectraBase Compound ID Ay4RdUzBPZV
InChI InChI=1S/C59H42N2O4/c62-58-56(64-46-19-3-1-4-20-46)54(52-48-23-11-7-15-40(48)36-41-16-8-12-24-49(41)52)60(58)44-31-27-38(28-32-44)35-39-29-33-45(34-30-39)61-55(57(59(61)63)65-47-21-5-2-6-22-47)53-50-25-13-9-17-42(50)37-43-18-10-14-26-51(43)53/h1-34,36-37,54-57H,35H2/t54-,55+,56-,57+
InChIKey VGXSCRWAPAFPNT-HUOQVOSKSA-N
Mol Weight 843.0 g/mol
Molecular Formula C59H42N2O4
Exact Mass 842.314458 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ggwLhKG0WU
Name 1,1'-[4,4'-METHYLENE-BIS-(4,1-PHENYLENE)]-BIS-[4-(ANTHRACEN-9-YL)-3-PHENOXY-AZETIDIN-2-ONE]
Compound Number 4E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C59H42N2O4
InChI InChI=1S/C59H42N2O4/c62-58-56(64-46-19-3-1-4-20-46)54(52-48-23-11-7-15-40(48)36-41-16-8-12-24-49(41)52)60(58)44-31-27-38(28-32-44)35-39-29-33-45(34-30-39)61-55(57(59(61)63)65-47-21-5-2-6-22-47)53-50-25-13-9-17-42(50)37-43-18-10-14-26-51(43)53/h1-34,36-37,54-57H,35H2/t54-,55+,56-,57+
InChIKey VGXSCRWAPAFPNT-HUOQVOSKSA-N
Literature Reference Author A.JARRAHPOUR,E.EBRAHIMI
Literature Reference Citation MOLECULES,15,515(2010)
Literature Reference DOI 10.3390/molecules15010515
Molecular Weight 842.993 g/mol
Sample ID 69213
Solvent Unknown