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2-CYANO-7-DIMETHYLAMINO-4,5,6,8,9,13B-HEXAHYDRO-11,12-DIMETHOXY-4-METHYL-3-OXOISOQUINOLO-[1,2-B]-2,6A-DIAZA-3A-AZONIAPHENALENE;CHLORIDE
SpectraBase Compound ID 46Q3OSTWbid
InChI InChI=1S/C24H28N5O3.ClH/c1-14-6-7-17-21(26(2)3)27-9-8-15-10-19(31-4)20(32-5)11-18(15)22(27)28-13-16(12-25)24(30)29(14)23(17)28;/h10-11,13-14,22H,6-9H2,1-5H3;1H/q+1;/p-1
InChIKey FUAVQCIIEUFBOJ-UHFFFAOYSA-M
Mol Weight 469.97 g/mol
Molecular Formula C24H28ClN5O3
Exact Mass 469.188067 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4c1OdjadbtT
Name 2-CYANO-7-DIMETHYLAMINO-4,5,6,8,9,13B-HEXAHYDRO-11,12-DIMETHOXY-4-METHYL-3-OXOISOQUINOLO-[1,2-B]-2,6A-DIAZA-3A-AZONIAPHENALENE;CHLORIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H28ClN5O3
InChI InChI=1S/C24H28N5O3.ClH/c1-14-6-7-17-21(26(2)3)27-9-8-15-10-19(31-4)20(32-5)11-18(15)22(27)28-13-16(12-25)24(30)29(14)23(17)28;/h10-11,13-14,22H,6-9H2,1-5H3;1H/q+1;/p-1
InChIKey FUAVQCIIEUFBOJ-UHFFFAOYSA-M
Literature Reference Author I.BITTER,B.PETE,B.AGAI,L.TOKE,G.TOTH,I.HERMECZ,K.SIMON,Z.MES ZAROS,L.PARKANYI
Literature Reference Citation HETEROCYCLES,26,2615(1987)
Literature Reference DOI 10.3987/R-1987-10-2615
Molecular Weight 469.971 g/mol
Solvent CDCl3:DMSO-D6
Source File Reference UWED25532