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Trans-2,2'-(vinylenedi-p-phenylene)dibenzoxazole

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 MS (GC)

Trans-2,2'-(vinylenedi-p-phenylene)dibenzoxazole
SpectraBase Compound ID 5NTBjaqaRx2
InChI InChI=1S/C28H18N2O2/c1-3-7-25-23(5-1)29-27(31-25)21-15-11-19(12-16-21)9-10-20-13-17-22(18-14-20)28-30-24-6-2-4-8-26(24)32-28/h1-18H/b10-9+
InChIKey ORACIQIJMCYPHQ-MDZDMXLPSA-N
Mol Weight 414.46 g/mol
Molecular Formula C28H18N2O2
Exact Mass 414.136828 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3SsJcYufQqe
Name Trans-2,2'-(vinylenedi-p-phenylene)dibenzoxazole
Comments Computed using HOSE algorithm
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Exact Mass 414.136827826 u
Formula C28H18N2O2
InChI InChI=1S/C28H18N2O2/c1-3-7-25-23(5-1)29-27(31-25)21-15-11-19(12-16-21)9-10-20-13-17-22(18-14-20)28-30-24-6-2-4-8-26(24)32-28/h1-18H/b10-9+
InChIKey ORACIQIJMCYPHQ-MDZDMXLPSA-N
Molecular Weight 414.464 g/mol
SMILES C=1C=CC2=C(C1)OC(=N2)C=1C=CC(=CC1)\C=C\C=1C=CC(=CC1)C1=NC2=C(O1)C=CC=C2