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4-(3-{9-[3-(4-aminophenoxy)phenyl]-9H-fluoren-9-yl}phenoxy)aniline
SpectraBase Compound ID 3fORbhIBk8p
InChI InChI=1S/C37H28N2O2/c38-27-15-19-29(20-16-27)40-31-9-5-7-25(23-31)37(35-13-3-1-11-33(35)34-12-2-4-14-36(34)37)26-8-6-10-32(24-26)41-30-21-17-28(39)18-22-30/h1-24H,38-39H2
InChIKey ZYJBYGKNZDCBIT-UHFFFAOYSA-N
Mol Weight 532.6 g/mol
Molecular Formula C37H28N2O2
Exact Mass 532.215078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A5bgNFy9Cor
Name 4-(3-{9-[3-(4-Aminophenoxy)phenyl]-9H-fluoren-9-yl}phenoxy)aniline
Comments Computed using HOSE algorithm
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Exact Mass 532.215078148 u
Formula C37H28N2O2
InChI InChI=1S/C37H28N2O2/c38-27-15-19-29(20-16-27)40-31-9-5-7-25(23-31)37(35-13-3-1-11-33(35)34-12-2-4-14-36(34)37)26-8-6-10-32(24-26)41-30-21-17-28(39)18-22-30/h1-24H,38-39H2
InChIKey ZYJBYGKNZDCBIT-UHFFFAOYSA-N
Molecular Weight 532.643 g/mol
SMILES NC1=CC=C(OC2=CC(C3(C=4C=C(OC=5C=CC(=CC5)N)C=CC4)C4=C(C=CC=C4)C=4C3=CC=CC4)=CC=C2)C=C1