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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 2sO2viUBzM6
Name 5-Bromo-2-methyl-8-nitro-1,2,3,4-tetrahydroisoquinolin-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
Literature Reference DOI 10.1002/hlca.19850680704
Molecular Weight 296.124 g/mol
SMILES C1N(C(Cc2c(ccc(c12)[N+](=O)[O-])Br)C#N)C
SPLASH splash10-0032-0190000000-c708d1cc9bd42c4a7de7
Source of Spectrum H-68-1832-7
Synonyms 5-Bromo-2-methyl-8-nitro-1,2,3,4-tetrahydroisoquinoline-3-carbonitrile
Wiley ID 1794902