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N-METHYL-1-BENZOYL-6-BENZYLOXY-7,3',4'-TRIMETHOXY-3,4-DIHYDROISOQUINOLINE
SpectraBase Compound ID BcrclByZ4Ga
InChI InChI=1S/C27H28NO5/c1-28-13-12-19-14-25(33-17-18-8-6-5-7-9-18)24(32-4)16-21(19)26(28)27(29)20-10-11-22(30-2)23(15-20)31-3/h5-11,14-16H,12-13,17H2,1-4H3/q+1
InChIKey GXTABJYCMZXUHZ-UHFFFAOYSA-N
Mol Weight 446.52 g/mol
Molecular Formula C27H28NO5
Exact Mass 446.196748 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D0eZFpZItBb
Name N-METHYL-1-BENZOYL-6-BENZYLOXY-7,3',4'-TRIMETHOXY-3,4-DIHYDROISOQUINOLINE
Compound Number 25A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H28NO5
InChI InChI=1S/C27H28NO5/c1-28-13-12-19-14-25(33-17-18-8-6-5-7-9-18)24(32-4)16-21(19)26(28)27(29)20-10-11-22(30-2)23(15-20)31-3/h5-11,14-16H,12-13,17H2,1-4H3/q+1
InChIKey GXTABJYCMZXUHZ-UHFFFAOYSA-N
Literature Reference Author A.BERMEJO,I.ANDREU,F.SUVIRE,S.LEONCE,D.H.CAIGNARD,P.RENARD,A .PIERRE,R.D.ENRIZ,D.
Literature Reference Citation J.MED.CHEM.,45,5058(2002)
Literature Reference DOI 10.1021/jm020831a
Molecular Weight 446.523 g/mol
Sample ID 65195
Solvent CDCl3