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[(E),(E)]-2,5-BIS-[2-(4-HEXYLOXYPHENYL)-ETHENYL]-3,6-DI-(1-NAPHTYL)-PYRAZINE
SpectraBase Compound ID BZNE54VuUS5
InChI InChI=1S/C52H52N2O2/c1-3-5-7-13-37-55-43-31-25-39(26-32-43)29-35-49-51(47-23-15-19-41-17-9-11-21-45(41)47)54-50(52(53-49)48-24-16-20-42-18-10-12-22-46(42)48)36-30-40-27-33-44(34-28-40)56-38-14-8-6-4-2/h9-12,15-36H,3-8,13-14,37-38H2,1-2H3/b35-29+,36-30+
InChIKey XBRNJZVUKCYEFM-ZRBLUKEISA-N
Mol Weight 737.0 g/mol
Molecular Formula C52H52N2O2
Exact Mass 736.402879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3s0KhG3HEHM
Name [(E),(E)]-2,5-BIS-[2-(4-HEXYLOXYPHENYL)-ETHENYL]-3,6-DI-(1-NAPHTYL)-PYRAZINE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C52H52N2O2
InChI InChI=1S/C52H52N2O2/c1-3-5-7-13-37-55-43-31-25-39(26-32-43)29-35-49-51(47-23-15-19-41-17-9-11-21-45(41)47)54-50(52(53-49)48-24-16-20-42-18-10-12-22-46(42)48)36-30-40-27-33-44(34-28-40)56-38-14-8-6-4-2/h9-12,15-36H,3-8,13-14,37-38H2,1-2H3/b35-29+,36-30+
InChIKey XBRNJZVUKCYEFM-ZRBLUKEISA-N
Literature Reference Author V.SCHMITT,S.MOSCHEL,H.DETERT
Literature Reference Citation EUR.J.ORG.CHEM.,2013,5655(2013)
Literature Reference DOI 10.1002/ejoc.201300463
Molecular Weight 736.997 g/mol
Solvent CDCl3
Source File Reference UWBT18301