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4'-[4-N-(2,4,6-TRIPHENYLPYRIDINIO)-PHENYL]-2,2':6',2''-TERPYRIDINE;[H3TP+-PTPY]
SpectraBase Compound ID KoCu6n6665k
InChI InChI=1S/C44H31N4/c1-4-14-32(15-5-1)37-30-43(34-16-6-2-7-17-34)48(44(31-37)35-18-8-3-9-19-35)38-24-22-33(23-25-38)36-28-41(39-20-10-12-26-45-39)47-42(29-36)40-21-11-13-27-46-40/h1-31H/q+1
InChIKey UDMQDVMZFDETCB-UHFFFAOYSA-N
Mol Weight 615.8 g/mol
Molecular Formula C44H31N4
Exact Mass 615.254872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4dIrhfrBjQR
Name 4'-[4-N-(2,4,6-TRIPHENYLPYRIDINIO)-PHENYL]-2,2':6',2''-TERPYRIDINE;[H3TP+-PTPY]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H31N4
InChI InChI=1S/C44H31N4/c1-4-14-32(15-5-1)37-30-43(34-16-6-2-7-17-34)48(44(31-37)35-18-8-3-9-19-35)38-24-22-33(23-25-38)36-28-41(39-20-10-12-26-45-39)47-42(29-36)40-21-11-13-27-46-40/h1-31H/q+1
InChIKey UDMQDVMZFDETCB-UHFFFAOYSA-N
Literature Reference Author P.LAINE,F.BEDIOUI,P.OCHSENBEIN,V.MARVAUD,M.BONIN,E.AMOUYAL
Literature Reference Citation J.AM.CHEM.SOC.,124,1364(2002)
Literature Reference DOI 10.1021/ja011069p
Molecular Weight 615.757 g/mol
Sample ID 47253
Solvent Unknown