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2-(ANTHRACEN-9-YL)-1-[4-[4-[2-(ANTHRACEN-9-YL)-4-OXOSPIRO-[AZETIDINE-3,9'-XANTHENE]-1-YL]-BENZYL]-PHENYL]-SPIRO-[AZETIDINE-3,9'-XANTHEN]-4-ONE
SpectraBase Compound ID L8WDGDxbEwy
InChI InChI=1S/C71H46N2O4/c74-68-70(56-25-9-13-29-60(56)76-61-30-14-10-26-57(61)70)66(64-52-21-5-1-17-46(52)42-47-18-2-6-22-53(47)64)72(68)50-37-33-44(34-38-50)41-45-35-39-51(40-36-45)73-67(65-54-23-7-3-19-48(54)43-49-20-4-8-24-55(49)65)71(69(73)75)58-27-11-15-31-62(58)77-63-32-16-12-28-59(63)71/h1-40,42-43,66-67H,41H2/t66-,67+
InChIKey YMIPFHOBXROJHY-SIKJLATJSA-N
Mol Weight 991.2 g/mol
Molecular Formula C71H46N2O4
Exact Mass 990.345758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BQChRz6e4KA
Name 2-(ANTHRACEN-9-YL)-1-[4-[4-[2-(ANTHRACEN-9-YL)-4-OXOSPIRO-[AZETIDINE-3,9'-XANTHENE]-1-YL]-BENZYL]-PHENYL]-SPIRO-[AZETIDINE-3,9'-XANTHEN]-4-ONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C71H46N2O4
InChI InChI=1S/C71H46N2O4/c74-68-70(56-25-9-13-29-60(56)76-61-30-14-10-26-57(61)70)66(64-52-21-5-1-17-46(52)42-47-18-2-6-22-53(47)64)72(68)50-37-33-44(34-38-50)41-45-35-39-51(40-36-45)73-67(65-54-23-7-3-19-48(54)43-49-20-4-8-24-55(49)65)71(69(73)75)58-27-11-15-31-62(58)77-63-32-16-12-28-59(63)71/h1-40,42-43,66-67H,41H2/t66-,67+
InChIKey YMIPFHOBXROJHY-SIKJLATJSA-N
Literature Reference Author A.JARRAHPOUR,E.EBRAHIMI
Literature Reference Citation MOLECULES,15,515(2010)
Literature Reference DOI 10.3390/molecules15010515
Molecular Weight 991.157 g/mol
Sample ID 69209
Solvent Unknown