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2,2',7,7'-Bis(1,4-oxymethylphenyl)bis(9H-fluoren-9-one)cyclophane
SpectraBase Compound ID KfKlzMpkJHP
InChI InChI=1S/C42H28O6/c43-41-37-17-29-9-13-33(37)35-15-11-31(19-39(35)41)47-23-27-5-7-28(8-6-27)24-48-32-12-16-36-34-14-10-30(18-38(34)42(44)40(36)20-32)46-22-26-2-1-25(3-4-26)21-45-29/h1-20H,21-24H2
InChIKey XORMSRGTNFOANO-UHFFFAOYSA-N
Mol Weight 628.7 g/mol
Molecular Formula C42H28O6
Exact Mass 628.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6g7IqRXOij6
Name 2,2',7,7'-Bis(1,4-oxymethylphenyl)bis(9H-fluoren-9-one)cyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H28O6
InChI InChI=1S/C42H28O6/c43-41-37-17-29-9-13-33(37)35-15-11-31(19-39(35)41)47-23-27-5-7-28(8-6-27)24-48-32-12-16-36-34-14-10-30(18-38(34)42(44)40(36)20-32)46-22-26-2-1-25(3-4-26)21-45-29/h1-20H,21-24H2
InChIKey XORMSRGTNFOANO-UHFFFAOYSA-N
Molecular Weight 628.680 g/mol
SMILES c12C(c3cc4OCc5ccc(COc6cc7C(c8cc(OCc9ccc(COc(c2)ccc1-c3cc4)cc9)ccc8-c7cc6)=O)cc5)=O
SPLASH splash10-0ufr-0911005000-ee14c116aead864afc5e
Source of Spectrum Y1-44-7376-6
Wiley ID 1621673