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7-BENZYLOXY-1-{4-[3-(2-METHYL-1,3-DIOXALAN-2-YL)]-PYRIDYLMETHYL}-6-METHOXYISOCHINOLINE
SpectraBase Compound ID 5J4KWqmPOMH
InChI InChI=1S/C27H26N2O4/c1-27(32-12-13-33-27)23-17-28-10-8-21(23)14-24-22-16-26(31-18-19-6-4-3-5-7-19)25(30-2)15-20(22)9-11-29-24/h3-11,15-17H,12-14,18H2,1-2H3
InChIKey PTXXAJMZEBHYIS-UHFFFAOYSA-N
Mol Weight 442.52 g/mol
Molecular Formula C27H26N2O4
Exact Mass 442.189257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D6LjjMMF6f8
Name 7-BENZYLOXY-1-{4-[3-(2-METHYL-1,3-DIOXALAN-2-YL)]-PYRIDYLMETHYL}-6-METHOXYISOCHINOLINE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H26N2O4
InChI InChI=1S/C27H26N2O4/c1-27(32-12-13-33-27)23-17-28-10-8-21(23)14-24-22-16-26(31-18-19-6-4-3-5-7-19)25(30-2)15-20(22)9-11-29-24/h3-11,15-17H,12-14,18H2,1-2H3
InChIKey PTXXAJMZEBHYIS-UHFFFAOYSA-N
Literature Reference Author E.REIMANN,H.RENZ
Literature Reference Citation MH.CHEM.,125,1397(1994)
Literature Reference DOI 10.1007/BF00811089
Molecular Weight 442.514 g/mol
Solvent CDCl3
Source File Reference UWPR1406