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9,10-Bis[(4-fluorophenyl)ethynyl]-1,8-diphenyl-9,10-dihydrophenanthrene-9,10-diol
SpectraBase Compound ID 2OhLx2qhqid
InChI InChI=1S/C42H26F2O2/c43-33-21-17-29(18-22-33)25-27-41(45)39-35(31-9-3-1-4-10-31)13-7-15-37(39)38-16-8-14-36(32-11-5-2-6-12-32)40(38)42(41,46)28-26-30-19-23-34(44)24-20-30/h1-24,45-46H
InChIKey JGOIEXNLDHBRSF-UHFFFAOYSA-N
Mol Weight 600.7 g/mol
Molecular Formula C42H26F2O2
Exact Mass 600.190086 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdtCB6QTvMb
Name 9,10-Bis[(4-fluorophenyl)ethynyl]-1,8-diphenyl-9,10-dihydrophenanthrene-9,10-diol
Appearance Colorless solid
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Exact Mass 600.190086401 u
Formula C42H26F2O2
InChI InChI=1S/C42H26F2O2/c43-33-21-17-29(18-22-33)25-27-41(45)39-35(31-9-3-1-4-10-31)13-7-15-37(39)38-16-8-14-36(32-11-5-2-6-12-32)40(38)42(41,46)28-26-30-19-23-34(44)24-20-30/h1-24,45-46H
InChIKey JGOIEXNLDHBRSF-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010 Ultra
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.201800150
Molecular Weight 600.665 g/mol
Reported Formula C42H26F2O2
SMILES OC1(C=2C(=CC=CC2C=2C=CC=C(C2C1(C#CC1=CC=C(C=C1)F)O)C1=CC=CC=C1)C1=CC=CC=C1)C#CC1=CC=C(C=C1)F
SPLASH splash10-001i-0009200000-ba81f6a06e29c2994a39
Source of Spectrum QE-24-6629-5c (DOI: 10.1002/chem.201800150)
Wiley ID 1901461