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(+-)-9,9'-biphenanthrene-10,10'-diol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(+-)-9,9'-biphenanthrene-10,10'-diol
SpectraBase Compound ID 9hxDkNknxUh
InChI InChI=1S/C28H18O2/c29-27-23-15-7-3-11-19(23)17-9-1-5-13-21(17)25(27)26-22-14-6-2-10-18(22)20-12-4-8-16-24(20)28(26)30/h1-16,29-30H
InChIKey AIRSOVDICMIOKM-UHFFFAOYSA-N
Mol Weight 386.45 g/mol
Molecular Formula C28H18O2
Exact Mass 386.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID cYIWQy6gNo
Name (+-)-9,9'-biphenanthrene-10,10'-diol
Comments Computed using HOSE algorithm
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Exact Mass 386.130679818 u
Formula C28H18O2
InChI InChI=1S/C28H18O2/c29-27-23-15-7-3-11-19(23)17-9-1-5-13-21(17)25(27)26-22-14-6-2-10-18(22)20-12-4-8-16-24(20)28(26)30/h1-16,29-30H
InChIKey AIRSOVDICMIOKM-UHFFFAOYSA-N
Molecular Weight 386.450 g/mol
SMILES C=1C=C2C(=CC1)C(O)=C(C1=C2C=CC=C1)C1=C(C=2C=CC=CC2C=2C=CC=CC12)O