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1,2-Bis[4-[2-(2-tert-butylphenyl)-1,3,4-oxadiazol-5-yl]phenyl]ethylene
SpectraBase Compound ID 2Xz2PotOOJa
InChI InChI=1S/C38H36N4O2/c1-37(2,3)31-13-9-7-11-29(31)35-41-39-33(43-35)27-21-17-25(18-22-27)15-16-26-19-23-28(24-20-26)34-40-42-36(44-34)30-12-8-10-14-32(30)38(4,5)6/h7-24H,1-6H3/b16-15+
InChIKey ICTYMXXOSJYRGX-FOCLMDBBSA-N
Mol Weight 580.7 g/mol
Molecular Formula C38H36N4O2
Exact Mass 580.283826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A2VlWKNIeY9
Name 1,2-Bis[4-[2-(2-tert-butylphenyl)-1,3,4-oxadiazol-5-yl]phenyl]ethylene
Alternate Name(s) 2-(2-tert-butylphenyl)-5-[4-((E)-2-{4-[5-(2-tert-butylphenyl)-1,3,4-oxadiazol-2-yl]phenyl}ethenyl)phenyl]-1,3,4-oxadiazole
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Formula C38H36N4O2
InChI InChI=1S/C38H36N4O2/c1-37(2,3)31-13-9-7-11-29(31)35-41-39-33(43-35)27-21-17-25(18-22-27)15-16-26-19-23-28(24-20-26)34-40-42-36(44-34)30-12-8-10-14-32(30)38(4,5)6/h7-24H,1-6H3/b16-15+
InChIKey ICTYMXXOSJYRGX-FOCLMDBBSA-N
Molecular Weight 580.732 g/mol
SMILES c1(oc(-c2ccc(\C=C\c3ccc(-c4oc(-c5c(C(C)(C)C)cccc5)nn4)cc3)cc2)nn1)-c1c(C(C)(C)C)cccc1
SPLASH splash10-001i-0110090000-dd12657d54a552873568
Source of Spectrum IC-1276-0-0
Wiley ID 1408541