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4-(ANTHRACEN-9-YL)-1-[3-[4-[2-(ANTHRACEN-9-YL)-4-OXO-3-PHENOXY-AZETIDIN-YL]-PHENOXY]-PHENYL]-3-PHENOXY-AZETIDIN-2-ONE
SpectraBase Compound ID LJHlW7iao9f
InChI InChI=1S/C58H40N2O5/c61-57-55(64-43-21-3-1-4-22-43)53(51-47-26-11-7-16-37(47)34-38-17-8-12-27-48(38)51)59(57)41-30-32-45(33-31-41)63-46-25-15-20-42(36-46)60-54(56(58(60)62)65-44-23-5-2-6-24-44)52-49-28-13-9-18-39(49)35-40-19-10-14-29-50(40)52/h1-36,53-56H/t53-,54+,55+,56-/m0/s1
InChIKey OZOURXGDOSLRKS-RIKIPNEESA-N
Mol Weight 845.0 g/mol
Molecular Formula C58H40N2O5
Exact Mass 844.293722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IhhtfvPo0Pv
Name 4-(ANTHRACEN-9-YL)-1-[3-[4-[2-(ANTHRACEN-9-YL)-4-OXO-3-PHENOXY-AZETIDIN-YL]-PHENOXY]-PHENYL]-3-PHENOXY-AZETIDIN-2-ONE
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C58H40N2O5
InChI InChI=1S/C58H40N2O5/c61-57-55(64-43-21-3-1-4-22-43)53(51-47-26-11-7-16-37(47)34-38-17-8-12-27-48(38)51)59(57)41-30-32-45(33-31-41)63-46-25-15-20-42(36-46)60-54(56(58(60)62)65-44-23-5-2-6-24-44)52-49-28-13-9-18-39(49)35-40-19-10-14-29-50(40)52/h1-36,53-56H/t53-,54+,55+,56-/m0/s1
InChIKey OZOURXGDOSLRKS-RIKIPNEESA-N
Literature Reference Author A.JARRAHPOUR,E.EBRAHIMI
Literature Reference Citation MOLECULES,15,515(2010)
Literature Reference DOI 10.3390/molecules15010515
Molecular Weight 844.966 g/mol
Sample ID 69216
Solvent Unknown