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7-BENZYL-5-(3,5-DIMETHYLPHENYL)-4-(4-METHOXYPHENYL)-7H-PYRROLO-[2,3-D]-PYRIMIDINE
SpectraBase Compound ID J7ul37IuTJP
InChI InChI=1S/C28H25N3O/c1-19-13-20(2)15-23(14-19)25-17-31(16-21-7-5-4-6-8-21)28-26(25)27(29-18-30-28)22-9-11-24(32-3)12-10-22/h4-15,17-18H,16H2,1-3H3
InChIKey MNLIOSHZQOBHGC-UHFFFAOYSA-N
Mol Weight 419.53 g/mol
Molecular Formula C28H25N3O
Exact Mass 419.199762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1b6D2Fi05fv
Name 7-BENZYL-5-(3,5-DIMETHYLPHENYL)-4-(4-METHOXYPHENYL)-7H-PYRROLO-[2,3-D]-PYRIMIDINE
Compound Number 5CB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H25N3O
InChI InChI=1S/C28H25N3O/c1-19-13-20(2)15-23(14-19)25-17-31(16-21-7-5-4-6-8-21)28-26(25)27(29-18-30-28)22-9-11-24(32-3)12-10-22/h4-15,17-18H,16H2,1-3H3
InChIKey MNLIOSHZQOBHGC-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 419.526 g/mol
Solvent CDCl3
Source File Reference UWLU85462