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(E,E)-1,4-Di-(4-phenoxyphenyl)-1,3-butadiene

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

(E,E)-1,4-Di-(4-phenoxyphenyl)-1,3-butadiene
SpectraBase Compound ID 1Mv7KyuBRYu
InChI InChI=1S/C28H22O2/c1-3-11-25(12-4-1)29-27-19-15-23(16-20-27)9-7-8-10-24-17-21-28(22-18-24)30-26-13-5-2-6-14-26/h1-22H/b9-7+,10-8+
InChIKey XCDSEYHZKHGNKA-FIFLTTCUSA-N
Mol Weight 390.48 g/mol
Molecular Formula C28H22O2
Exact Mass 390.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1SMpq2oh6nC
Name (E,E)-1,4-di-(4-Phenoxyphenyl)-1,3-butadiene
Comments Computed using HOSE algorithm
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Exact Mass 390.161979946 u
Formula C28H22O2
InChI InChI=1S/C28H22O2/c1-3-11-25(12-4-1)29-27-19-15-23(16-20-27)9-7-8-10-24-17-21-28(22-18-24)30-26-13-5-2-6-14-26/h1-22H/b9-7+,10-8+
InChIKey XCDSEYHZKHGNKA-FIFLTTCUSA-N
Molecular Weight 390.482 g/mol
SMILES C=1C=C(C=CC1OC1=CC=CC=C1)\C=C\C=C\C=1C=CC(OC2=CC=CC=C2)=CC1