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Isoquinoline, 1,2,3,4-tetrahydro-1-(4-bromophenyl)-6,7-dimethoxy-

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

Isoquinoline, 1,2,3,4-tetrahydro-1-(4-bromophenyl)-6,7-dimethoxy-
SpectraBase Compound ID INNlqQomNfh
InChI InChI=1S/C17H18BrNO2/c1-20-15-9-12-7-8-19-17(14(12)10-16(15)21-2)11-3-5-13(18)6-4-11/h3-6,9-10,17,19H,7-8H2,1-2H3
InChIKey AFGIYTBFSNPSMM-UHFFFAOYSA-N
Mol Weight 348.24 g/mol
Molecular Formula C17H18BrNO2
Exact Mass 347.052092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FaJeFqYZzhp
Name Isoquinoline, 1,2,3,4-tetrahydro-1-(4-bromophenyl)-6,7-dimethoxy-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.052091822 u
Formula C17H18BrNO2
InChI InChI=1S/C17H18BrNO2/c1-20-15-9-12-7-8-19-17(14(12)10-16(15)21-2)11-3-5-13(18)6-4-11/h3-6,9-10,17,19H,7-8H2,1-2H3
InChIKey AFGIYTBFSNPSMM-UHFFFAOYSA-N
Molecular Weight 348.240 g/mol
SMILES C12=CC(=C(C=C2CCNC1C=1C=CC(=CC1)Br)OC)OC