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5-Brom-2-methyl-8-nitro-1,4-dihydroisochinolinium-chlorid

View entire compound with spectra: 2 MS (GC)

5-Brom-2-methyl-8-nitro-1,4-dihydroisochinolinium-chlorid
SpectraBase Compound ID 7neUE4xeWR5
InChI InChI=1S/C10H10BrN2O2.ClH/c1-12-5-4-7-8(6-12)10(13(14)15)3-2-9(7)11;/h2-3,5H,4,6H2,1H3;1H/q+1;/p-1
InChIKey CRXVTFLJTQFPTC-UHFFFAOYSA-M
Mol Weight 305.56 g/mol
Molecular Formula C10H10BrClN2O2
Exact Mass 303.961418 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6B1vlyQNHnY
Name 5-Bromo-2-methyl-8-nitro-1,4-dihydroisoquinolinium-chloride
Alternate Name(s) 5-Bromo-2-methyl-8-nitro-1,4-dihydroisoquinolin-2-ium chloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10BrClN2O2
InChI InChI=1S/C10H10BrN2O2.ClH/c1-12-5-4-7-8(6-12)10(13(14)15)3-2-9(7)11;/h2-3,5H,4,6H2,1H3;1H/q+1;/p-1
InChIKey CRXVTFLJTQFPTC-UHFFFAOYSA-M
Molecular Weight 305.559 g/mol
SMILES C1[N+](=CCc2c(ccc(c12)[N+](=O)[O-])Br)C.[Cl-]
SPLASH splash10-0006-0950000000-f8ee19baeaec98823b16
Source of Spectrum H-68-1833-10
Wiley ID 1794900