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1-(2-Bromo-4,5-dimethoxybenzyl)-6,7-methylenedioxy-1,2,3,4-dihydroisoquinoline

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

1-(2-Bromo-4,5-dimethoxybenzyl)-6,7-methylenedioxy-1,2,3,4-dihydroisoquinoline
SpectraBase Compound ID 48wvWPP0pVD
InChI InChI=1S/C19H20BrNO4/c1-22-16-7-12(14(20)9-17(16)23-2)5-15-13-8-19-18(24-10-25-19)6-11(13)3-4-21-15/h6-9,15,21H,3-5,10H2,1-2H3
InChIKey AOQIPBCFAFHMRM-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 4f8Bf4Djcv9
Name 1-(2-Bromo-4,5-dimethoxybenzyl)-6,7-methylenedioxy-1,2,3,4-dihydroisoquinoline
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/c1-22-16-7-12(14(20)9-17(16)23-2)5-15-13-8-19-18(24-10-25-19)6-11(13)3-4-21-15/h6-9,15,21H,3-5,10H2,1-2H3
InChIKey AOQIPBCFAFHMRM-UHFFFAOYSA-N
Molecular Weight 406.276 g/mol
SMILES C1=2C(CC3=C(C=C(C(=C3)OC)OC)Br)NCCC1=CC=1OCOC1C2