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1,2-BIS-[ORTHO-(N-METHYLIDENAMINO-3,5-DIPHENYL-4H-1,2,4-TRIAZOLE-4-YL)-PHENOXY]-ETHANE

View entire compound with spectra: 1 NMR

1,2-BIS-[ORTHO-(N-METHYLIDENAMINO-3,5-DIPHENYL-4H-1,2,4-TRIAZOLE-4-YL)-PHENOXY]-ETHANE
SpectraBase Compound ID K0e5kuGwOlh
InChI InChI=1S/C44H34N8O2/c1-5-17-33(18-6-1)41-47-48-42(34-19-7-2-8-20-34)51(41)45-31-37-25-13-15-27-39(37)53-29-30-54-40-28-16-14-26-38(40)32-46-52-43(35-21-9-3-10-22-35)49-50-44(52)36-23-11-4-12-24-36/h1-28,31-32H,29-30H2/b45-31+,46-32+
InChIKey YSDSFOIGBZIZOU-RQAFMBFTSA-N
Mol Weight 706.8 g/mol
Molecular Formula C44H34N8O2
Exact Mass 706.280472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FYGd75j8QoS
Name 1,2-BIS-[ORTHO-(N-METHYLIDENAMINO-3,5-DIPHENYL-4H-1,2,4-TRIAZOLE-4-YL)-PHENOXY]-ETHANE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H34N8O2
InChI InChI=1S/C44H34N8O2/c1-5-17-33(18-6-1)41-47-48-42(34-19-7-2-8-20-34)51(41)45-31-37-25-13-15-27-39(37)53-29-30-54-40-28-16-14-26-38(40)32-46-52-43(35-21-9-3-10-22-35)49-50-44(52)36-23-11-4-12-24-36/h1-28,31-32H,29-30H2/b45-31+,46-32+
InChIKey YSDSFOIGBZIZOU-RQAFMBFTSA-N
Literature Reference Author O.BEKIRCAN,H.BEKTAS
Literature Reference Citation MOLECULES,11,469(2006)
Literature Reference DOI 10.3390/11060469
Molecular Weight 706.806 g/mol
Sample ID 38589
Solvent DMSO-D6