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1-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-7-methoxy-8-phenylmethoxy-isoquinoline
SpectraBase Compound ID 5uGOypEWp4m
InChI InChI=1S/C26H24BrNO4/c1-29-22-10-9-19-11-12-28-21(14-18-13-20(27)25(31-3)23(15-18)30-2)24(19)26(22)32-16-17-7-5-4-6-8-17/h4-13,15H,14,16H2,1-3H3
InChIKey LFOCENDXBAGZGA-UHFFFAOYSA-N
Mol Weight 494.39 g/mol
Molecular Formula C26H24BrNO4
Exact Mass 493.088871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZkujCjCrNr
Name 1-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]-7-methoxy-8-phenylmethoxy-isoquinoline
Alternate Name(s) 1-[(3-bromo-4,5-dimethoxyphenyl)methyl]-7-methoxy-8-phenylmethoxyisoquinoline 8-Benzoxy-1-(3-bromo-4,5-dimethoxy-benzyl)-7-methoxy-isoquinoline 8-Benzyloxy-1-[(3-bromo-4,5-dimethoxy-phenyl)methyl]-7-methoxy-isoquinoline
CAS Registry Number 113756-67-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H24BrNO4
InChI InChI=1S/C26H24BrNO4/c1-29-22-10-9-19-11-12-28-21(14-18-13-20(27)25(31-3)23(15-18)30-2)24(19)26(22)32-16-17-7-5-4-6-8-17/h4-13,15H,14,16H2,1-3H3
InChIKey LFOCENDXBAGZGA-UHFFFAOYSA-N
Molecular Weight 494.385 g/mol
SMILES c1(c2c(OCc3ccccc3)c(OC)ccc2ccn1)Cc1cc(Br)c(c(c1)OC)OC
SPLASH splash10-0006-9000100000-e82d412d321a954e647a
Source of Spectrum Y-24-618-5
Wiley ID 1397721