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1-(2-Bromo-4,5-methylenedioxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(2-Bromo-4,5-methylenedioxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID 5GSOh3Mvxt1
InChI InChI=1S/C19H20BrNO4/c1-22-16-6-11-3-4-21-15(13(11)8-17(16)23-2)5-12-7-18-19(9-14(12)20)25-10-24-18/h6-9,15,21H,3-5,10H2,1-2H3
InChIKey KSHBNLOLBJYIDF-UHFFFAOYSA-N
Mol Weight 406.28 g/mol
Molecular Formula C19H20BrNO4
Exact Mass 405.057571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DpwMuHWpZI2
Name 1-(2-Bromo-4,5-methylenedioxybenzyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 405.057571124 u
Formula C19H20BrNO4
InChI InChI=1S/C19H20BrNO4/c1-22-16-6-11-3-4-21-15(13(11)8-17(16)23-2)5-12-7-18-19(9-14(12)20)25-10-24-18/h6-9,15,21H,3-5,10H2,1-2H3
InChIKey KSHBNLOLBJYIDF-UHFFFAOYSA-N
Molecular Weight 406.276 g/mol
SMILES C1(NCCC=2C=C(C(=CC12)OC)OC)CC=1C(=CC2=C(C1)OCO2)Br