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Isoquinoline, 5-bromo-6,7-dimethoxy-1-methyl-8-nitro-
SpectraBase Compound ID 75dCTQ5Lx3S
InChI InChI=1S/C12H11BrN2O4/c1-6-8-7(4-5-14-6)9(13)11(18-2)12(19-3)10(8)15(16)17/h4-5H,1-3H3
InChIKey QJIIHWGLZGDTRM-UHFFFAOYSA-N
Mol Weight 327.13 g/mol
Molecular Formula C12H11BrN2O4
Exact Mass 325.99022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYGcOfAohQI
Name Isoquinoline, 5-bromo-6,7-dimethoxy-1-methyl-8-nitro-
Alternate Name(s) 5-Bromo-1-methyl-6,7-dimethoxy-8-nitroisoquinoline 5-Bromo-6,7-dimethoxy-1-methyl-8-nitroisoquinoline
CAS Registry Number 128428-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11BrN2O4
InChI InChI=1S/C12H11BrN2O4/c1-6-8-7(4-5-14-6)9(13)11(18-2)12(19-3)10(8)15(16)17/h4-5H,1-3H3
InChIKey QJIIHWGLZGDTRM-UHFFFAOYSA-N
Molecular Weight 327.134 g/mol
SMILES c1(c(c(OC)c(c2c1c(ncc2)C)Br)OC)N(=O)=O
SPLASH splash10-004i-0019000000-3b5a084884cc1694eae3
Source of Spectrum KC-1990-3195-3
Wiley ID 1324363