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8-Isoquinolinol, 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-7-methoxy-
SpectraBase Compound ID LNouRJgLIot
InChI InChI=1S/C18H14BrNO4/c1-22-14-3-2-10-4-5-20-13(17(10)18(14)21)6-11-7-15-16(8-12(11)19)24-9-23-15/h2-5,7-8,21H,6,9H2,1H3
InChIKey PSXOLAQIOMJDLZ-UHFFFAOYSA-N
Mol Weight 388.22 g/mol
Molecular Formula C18H14BrNO4
Exact Mass 387.010621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5p0UDszsfcw
Name 8-Isoquinolinol, 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-7-methoxy-
CAS Registry Number 86817-57-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14BrNO4
InChI InChI=1S/C18H14BrNO4/c1-22-14-3-2-10-4-5-20-13(17(10)18(14)21)6-11-7-15-16(8-12(11)19)24-9-23-15/h2-5,7-8,21H,6,9H2,1H3
InChIKey PSXOLAQIOMJDLZ-UHFFFAOYSA-N
Molecular Weight 388.217 g/mol
SMILES Oc1c2c(Cc3c(cc4c(c3)OCO4)Br)nccc2ccc1OC
SPLASH splash10-0a4i-0039000000-ea40031df22cf13f0430
Source of Spectrum Y-24-618-9
Synonyms 1-(2'-Bromo-4',5'-methylenedioxybenzyl)-7-methoxyisoquinolin-8-ol 1-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-7-methoxy-8-isoquinolinol
Wiley ID 1363303