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2-Bromo-4-nitrotoluene
SpectraBase Compound ID FbO0cJmG92H
InChI InChI=1S/C7H6BrNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3
InChIKey XFZFJQHXWJIBQV-UHFFFAOYSA-N
Mol Weight 216.03 g/mol
Molecular Formula C7H6BrNO2
Exact Mass 214.958191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BdBCN848G
Name Benzene, 2-bromo-1-methyl-4-nitro-
CAS Registry Number 7745-93-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6BrNO2
InChI InChI=1S/C7H6BrNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3
InChIKey XFZFJQHXWJIBQV-UHFFFAOYSA-N
Molecular Weight 216.034 g/mol
SMILES c1(N(=O)=O)cc(Br)c(C)cc1
SPLASH splash10-014u-9230000000-170e489bc1e67709970e
Source of Spectrum W5-1989-26561-1
Synonyms 2-Bromo-1-methyl-4-nitrobenzene 1-Bromo-2-methyl-5-nitrobenzene 2-Bromanyl-1-methyl-4-nitro-benzene 2-Bromo-4-nitrotoluene Toluene, 2-bromo-4-nitro- EINECS 231-809-9
Wiley ID 1214306