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WLJIPRNMMPGELJ-FTAYAITPSA-N

View entire compound with spectra: 1 NMR

WLJIPRNMMPGELJ-FTAYAITPSA-N
SpectraBase Compound ID 79oTarwCFKe
InChI InChI=1S/C44H30N4.C4H10N.Al/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;1-3-5-4-2;/h1-28,33,41H;3-4H2,1-2H3;/q-2;-1;+3/b42-37-,43-38-,44-39-;;
InChIKey WLJIPRNMMPGELJ-FTAYAITPSA-N
Mol Weight 713.9 g/mol
Molecular Formula C48H40AlN5
Exact Mass 713.30991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3OM1Be8Z65Y
Name WLJIPRNMMPGELJ-FTAYAITPSA-N
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H40AlN5
InChI InChI=1S/C44H30N4.C4H10N.Al/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;1-3-5-4-2;/h1-28,33,41H;3-4H2,1-2H3;/q-2;-1;+3/b42-37-,43-38-,44-39-;;
InChIKey WLJIPRNMMPGELJ-FTAYAITPSA-N
Literature Reference Author Y.HIRAI,T.AIDA,S.INOUE
Literature Reference Citation J.AM.CHEM.SOC.,111,3062(1989)
Literature Reference DOI 10.1021/ja00190a049
Molecular Weight 713.861 g/mol
Solvent C6D6
Source File Reference UWED11222