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2-(6,7-DIMETHOXY-3-METHYLISOQUINOLIN-1-YLMETHYL)-4,5-DIMETHOXYBENZONITRILE
SpectraBase Compound ID KwsdF0ymMmf
InChI InChI=1S/C22H22N2O4/c1-13-6-15-9-20(26-3)22(28-5)11-17(15)18(24-13)7-14-8-19(25-2)21(27-4)10-16(14)12-23/h6,8-11H,7H2,1-5H3
InChIKey LBGAIZDZSXRSML-UHFFFAOYSA-N
Mol Weight 378.43 g/mol
Molecular Formula C22H22N2O4
Exact Mass 378.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EOrHZ3XxqeS
Name 2-(6,7-DIMETHOXY-3-METHYLISOQUINOLIN-1-YLMETHYL)-4,5-DIMETHOXYBENZONITRILE
Compound Number 18C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22N2O4
InChI InChI=1S/C22H22N2O4/c1-13-6-15-9-20(26-3)22(28-5)11-17(15)18(24-13)7-14-8-19(25-2)21(27-4)10-16(14)12-23/h6,8-11H,7H2,1-5H3
InChIKey LBGAIZDZSXRSML-UHFFFAOYSA-N
Literature Reference Author E.REIMANN,R.HERTEL,J.KRAUSS
Literature Reference Citation MH.CHEM.,139,673(2008)
Literature Reference DOI 10.1007/s00706-007-0826-8
Molecular Weight 378.428 g/mol
Sample ID 39774
Solvent CDCl3