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Isoquinoline, 4,5,8-tribromo-6,7-dimethoxy-1-methyl-
SpectraBase Compound ID 3h0xy3kzzDy
InChI InChI=1S/C12H10Br3NO2/c1-5-7-8(6(13)4-16-5)10(15)12(18-3)11(17-2)9(7)14/h4H,1-3H3
InChIKey NRAYPTQJSYZWQD-UHFFFAOYSA-N
Mol Weight 439.93 g/mol
Molecular Formula C12H10Br3NO2
Exact Mass 436.826168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FR9Y9R0MGpI
Name Isoquinoline, 4,5,8-tribromo-6,7-dimethoxy-1-methyl-
CAS Registry Number 132213-46-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Br3NO2
InChI InChI=1S/C12H10Br3NO2/c1-5-7-8(6(13)4-16-5)10(15)12(18-3)11(17-2)9(7)14/h4H,1-3H3
InChIKey NRAYPTQJSYZWQD-UHFFFAOYSA-N
Molecular Weight 439.929 g/mol
SMILES c12c(c(Br)c(c(c2Br)OC)OC)c(Br)cnc1C
SPLASH splash10-03di-0009100000-231c2ed277681e8b7944
Source of Spectrum KC-1990-3195-3
Synonyms 4,5,8-Tribromo-6,7-dimethoxy-1-methylisoquinoline
Wiley ID 1383721