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2,2'-p-Phenylenebis[3-phenylquinoxaline]
SpectraBase Compound ID 2fUNfhQw68k
InChI InChI=1S/C34H22N4/c1-3-11-23(12-4-1)31-33(37-29-17-9-7-15-27(29)35-31)25-19-21-26(22-20-25)34-32(24-13-5-2-6-14-24)36-28-16-8-10-18-30(28)38-34/h1-22H
InChIKey XDBCCBAEHKUOEG-UHFFFAOYSA-N
Mol Weight 486.6 g/mol
Molecular Formula C34H22N4
Exact Mass 486.184447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GTL0NjpKtYy
Name 2,2'-p-Phenylenebis[3-phenylquinoxaline]
Comments Computed using HOSE algorithm
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Exact Mass 486.184446724 u
Formula C34H22N4
InChI InChI=1S/C34H22N4/c1-3-11-23(12-4-1)31-33(37-29-17-9-7-15-27(29)35-31)25-19-21-26(22-20-25)34-32(24-13-5-2-6-14-24)36-28-16-8-10-18-30(28)38-34/h1-22H
InChIKey XDBCCBAEHKUOEG-UHFFFAOYSA-N
Molecular Weight 486.578 g/mol
SMILES C=1C(=CC=C(C1)C=1C(=NC=2C=CC=CC2N1)C=1C=CC=CC1)C=1C(=NC=2C=CC=CC2N1)C=1C=CC=CC1