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1-[2-(ETHOXYCARBONYL)-ETHYL]-6,7-DIMETHOXY-2-PROPYL-3,4-DIHYDRO-ISOQUINOLINIUM-BROMIDE
SpectraBase Compound ID 7g8FvKMSpYn
InChI InChI=1S/C19H28NO4.BrH/c1-5-10-20-11-9-14-12-17(22-3)18(23-4)13-15(14)16(20)7-8-19(21)24-6-2;/h12-13H,5-11H2,1-4H3;1H/q+1;/p-1
InChIKey PRBCIIUOAPJILL-UHFFFAOYSA-M
Mol Weight 414.34 g/mol
Molecular Formula C19H28BrNO4
Exact Mass 413.120171 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 570fa0NwxeO
Name 1-[2-(ETHOXYCARBONYL)-ETHYL]-6,7-DIMETHOXY-2-PROPYL-3,4-DIHYDRO-ISOQUINOLINIUM-BROMIDE
Compound Number 44
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H28BrNO4
InChI InChI=1S/C19H28NO4.BrH/c1-5-10-20-11-9-14-12-17(22-3)18(23-4)13-15(14)16(20)7-8-19(21)24-6-2;/h12-13H,5-11H2,1-4H3;1H/q+1;/p-1
InChIKey PRBCIIUOAPJILL-UHFFFAOYSA-M
Literature Reference Author J.B.BREMNER,B.COBAN,R.GRIFFITH,K.M.GROENEWOUD,B.F.YATES
Literature Reference Citation BIOORG.MED.CHEM.,8,201(2000)
Literature Reference DOI 10.1016/S0968-0896(99)00263-1
Molecular Weight 414.340 g/mol
Solvent CDCl3
Source File Reference UWVN20085