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5-Bromo-2-methyl-8-nitro-1,2,3,4-tetrahydroisoquinolin-3-carbonitrile
SpectraBase Compound ID LMURkOHlaFs
InChI InChI=1S/C11H10BrN3O2/c1-14-6-9-8(4-7(14)5-13)10(12)2-3-11(9)15(16)17/h2-3,7H,4,6H2,1H3
InChIKey YGUKMMOFUPCTSE-UHFFFAOYSA-N
Mol Weight 296.12 g/mol
Molecular Formula C11H10BrN3O2
Exact Mass 294.99564 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWesK3DmBAA
Name 3-Isoquinolinecarbonitrile, 5-bromo-1,2,3,4-tetrahydro-2-methyl-8-nitro-
CAS Registry Number 104737-01-1
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Formula C11H10BrN3O2
InChI InChI=1S/C11H10BrN3O2/c1-14-6-9-8(4-7(14)5-13)10(12)2-3-11(9)15(16)17/h2-3,7H,4,6H2,1H3
InChIKey YGUKMMOFUPCTSE-UHFFFAOYSA-N
Molecular Weight 296.124 g/mol
SMILES c12c(N(=O)=O)ccc(c2CC(N(C1)C)C#N)Br
SPLASH splash10-0ugj-0090000000-f85fecd50fc4c76e3d24
Source of Spectrum H-68-1832-7
Synonyms 5-Brom-2-methyl-8-nitro-1,2,3,4-tetrahydroisochinolin-3-carbonitril 5-Bromo-2-methyl-8-nitro-1,2,3,4-tetrahydro-3-isoquinolinecarbonitrile
Wiley ID 1297946