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1,1'-(1,4-PHENYLENE)-BIS-[2-(ANTHRACEN-9-YL)-SPIRO-[AZETIDINE-3,9'-XANTHEN]-4-ONE]
SpectraBase Compound ID 9RVaOZeD67h
InChI InChI=1S/C64H40N2O4/c67-61-63(49-25-9-13-29-53(49)69-54-30-14-10-26-50(54)63)59(57-45-21-5-1-17-39(45)37-40-18-2-6-22-46(40)57)65(61)43-33-35-44(36-34-43)66-60(58-47-23-7-3-19-41(47)38-42-20-4-8-24-48(42)58)64(62(66)68)51-27-11-15-31-55(51)70-56-32-16-12-28-52(56)64/h1-38,59-60H/t59-,60-/m1/s1
InChIKey SRHNJSPDLXKOJF-FNSAWIKJSA-N
Mol Weight 901.0 g/mol
Molecular Formula C64H40N2O4
Exact Mass 900.298808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9lZqqSD9FbJ
Name 1,1'-(1,4-PHENYLENE)-BIS-[2-(ANTHRACEN-9-YL)-SPIRO-[AZETIDINE-3,9'-XANTHEN]-4-ONE]
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C64H40N2O4
InChI InChI=1S/C64H40N2O4/c67-61-63(49-25-9-13-29-53(49)69-54-30-14-10-26-50(54)63)59(57-45-21-5-1-17-39(45)37-40-18-2-6-22-46(40)57)65(61)43-33-35-44(36-34-43)66-60(58-47-23-7-3-19-41(47)38-42-20-4-8-24-48(42)58)64(62(66)68)51-27-11-15-31-55(51)70-56-32-16-12-28-52(56)64/h1-38,59-60H/t59-,60-/m1/s1
InChIKey SRHNJSPDLXKOJF-FNSAWIKJSA-N
Literature Reference Author A.JARRAHPOUR,E.EBRAHIMI
Literature Reference Citation MOLECULES,15,515(2010)
Literature Reference DOI 10.3390/molecules15010515
Molecular Weight 901.033 g/mol
Sample ID 69218
Solvent Unknown