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4,4'-BIS-[PARA-[(N-BUTYL-N-TETRAHYDROPYRANYLOXYBUTYL)-AMINO]-PHENYLAZOSTYRYL]-2,2'-BIPYRIDINE
SpectraBase Compound ID HLZFPjaFWWU
InChI InChI=1S/C64H78N8O4/c1-3-5-41-71(43-9-13-47-75-63-15-7-11-45-73-63)59-33-29-57(30-34-59)69-67-55-25-21-51(22-26-55)17-19-53-37-39-65-61(49-53)62-50-54(38-40-66-62)20-18-52-23-27-56(28-24-52)68-70-58-31-35-60(36-32-58)72(42-6-4-2)44-10-14-48-76-64-16-8-12-46-74-64/h17-40,49-50,63-64H,3-16,41-48H2,1-2H3/b19-17+,20-18+,69-67+,70-68+
InChIKey WFNPLRXHIFDAIG-TZUWWRQVSA-N
Mol Weight 1023.4 g/mol
Molecular Formula C64H78N8O4
Exact Mass 1022.614603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F05kwuwC2oq
Name 4,4'-BIS-[PARA-[(N-BUTYL-N-TETRAHYDROPYRANYLOXYBUTYL)-AMINO]-PHENYLAZOSTYRYL]-2,2'-BIPYRIDINE
Compound Number 1B '
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C64H78N8O4
InChI InChI=1S/C64H78N8O4/c1-3-5-41-71(43-9-13-47-75-63-15-7-11-45-73-63)59-33-29-57(30-34-59)69-67-55-25-21-51(22-26-55)17-19-53-37-39-65-61(49-53)62-50-54(38-40-66-62)20-18-52-23-27-56(28-24-52)68-70-58-31-35-60(36-32-58)72(42-6-4-2)44-10-14-48-76-64-16-8-12-46-74-64/h17-40,49-50,63-64H,3-16,41-48H2,1-2H3/b19-17+,20-18+,69-67+,70-68+
InChIKey WFNPLRXHIFDAIG-TZUWWRQVSA-N
Literature Reference Author L.VIAU,S.BIDAULT,O.MAURY,S.BRASSELET,I.LEDOUX,J.ZYSS,E.ISHOW ,K.NAKATANI,H.L.BOZE
Literature Reference Citation J.AM.CHEM.SOC.,126,8386(2004)
Literature Reference DOI 10.1021/ja048143z
Molecular Weight 1023.375 g/mol
Solvent CDCl3
Source File Reference UWVN31442