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

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

1-(2-Bromo-4,5-dimethoxybenzyl)-2-(1-phenylethyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
SpectraBase Compound ID YXDCTIrITR
InChI InChI=1S/C28H32BrNO4/c1-18(19-9-7-6-8-10-19)30-12-11-20-14-25(31-2)27(33-4)16-22(20)24(30)13-21-15-26(32-3)28(34-5)17-23(21)29/h6-10,14-18,24H,11-13H2,1-5H3
InChIKey ZHWFBLNVARPHBU-UHFFFAOYSA-N
Mol Weight 526.5 g/mol
Molecular Formula C28H32BrNO4
Exact Mass 525.151472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1mEZsVDuea1
Name 1-(2-Bromo-4,5-dimethoxybenzyl)-2-(1-phenylethyl)-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 525.151471510 u
Formula C28H32BrNO4
InChI InChI=1S/C28H32BrNO4/c1-18(19-9-7-6-8-10-19)30-12-11-20-14-25(31-2)27(33-4)16-22(20)24(30)13-21-15-26(32-3)28(34-5)17-23(21)29/h6-10,14-18,24H,11-13H2,1-5H3
InChIKey ZHWFBLNVARPHBU-UHFFFAOYSA-N
Molecular Weight 526.471 g/mol
SMILES C1(N(CCC=2C=C(C(=CC12)OC)OC)C(C)C=1C=CC=CC1)CC=1C(=CC(=C(C1)OC)OC)Br