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7-BENZYL-4,5-BIS-(3,5-DIMETHYLPHENYL)-7H-PYRROLO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID 5wFlpP5JExM
InChI InChI=1S/C29H27N3/c1-19-10-20(2)13-24(12-19)26-17-32(16-23-8-6-5-7-9-23)29-27(26)28(30-18-31-29)25-14-21(3)11-22(4)15-25/h5-15,17-18H,16H2,1-4H3
InChIKey WIMQAZJETGXQJF-UHFFFAOYSA-N
Mol Weight 417.56 g/mol
Molecular Formula C29H27N3
Exact Mass 417.220498 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DRgUMB2oexj
Name 7-BENZYL-4,5-BIS-(3,5-DIMETHYLPHENYL)-7H-PYRROLO-[2,3-D]-PYRIMIDINE
Compound Number 5CC
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H27N3
InChI InChI=1S/C29H27N3/c1-19-10-20(2)13-24(12-19)26-17-32(16-23-8-6-5-7-9-23)29-27(26)28(30-18-31-29)25-14-21(3)11-22(4)15-25/h5-15,17-18H,16H2,1-4H3
InChIKey WIMQAZJETGXQJF-UHFFFAOYSA-N
Literature Reference Author M.KROEMER,M.KLEKA,L.SLAVETINSKA,B.KLEPETAROVA,M.HOCEK
Literature Reference Citation EUR.J.ORG.CHEM.,2014,7203(2014)
Literature Reference DOI 10.1002/ejoc.201402882
Molecular Weight 417.553 g/mol
Solvent CDCl3
Source File Reference UWLU85463