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3.5-Dimethyl-4-nitro-1-Bromomethyl-benzene
SpectraBase Compound ID EeeGMdh6bk0
InChI InChI=1S/C9H10BrNO2/c1-6-3-8(5-10)4-7(2)9(6)11(12)13/h3-4H,5H2,1-2H3
InChIKey FZRXXCZRAATQOY-UHFFFAOYSA-N
Mol Weight 244.09 g/mol
Molecular Formula C9H10BrNO2
Exact Mass 242.989492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dvf502tw8
Name 3.5-Dimethyl-4-nitro-1-Bromomethyl-benzene
Alternate Name(s) 5-Bromomethyl-1,3-dimethyl-2-nitro-benzene 5-(bromomethyl)-1,3-dimethyl-2-nitrobenzene
Comments Less than 3 mono-isotopic peaks
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Formula C9H10BrNO2
InChI InChI=1S/C9H10BrNO2/c1-6-3-8(5-10)4-7(2)9(6)11(12)13/h3-4H,5H2,1-2H3
InChIKey FZRXXCZRAATQOY-UHFFFAOYSA-N
Molecular Weight 244.088 g/mol
SMILES c1(N(=O)=O)c(cc(cc1C)CBr)C
SPLASH splash10-0007-0090000000-d10dd860b4a9a75a7dec
Source of Spectrum C-127-11725-A
Wiley ID 1701565