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3-Bromo-5-nitrotoluene
SpectraBase Compound ID 7bID7uRDKv5
InChI InChI=1S/C7H6BrNO2/c1-5-2-6(8)4-7(3-5)9(10)11/h2-4H,1H3
InChIKey MWFDNXJPZUOTJB-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 FKcg9cUcXAi
Name 3-Bromo-5-nitrotoluene
Alternate Name(s) 1-Bromanyl-3-methyl-5-nitro-benzene 1-Bromo-3-methyl-5-nitro-benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6BrNO2
InChI InChI=1S/C7H6BrNO2/c1-5-2-6(8)4-7(3-5)9(10)11/h2-4H,1H3
InChIKey MWFDNXJPZUOTJB-UHFFFAOYSA-N
Molecular Weight 216.034 g/mol
SMILES c1(cc(cc(c1)N(=O)=O)Br)C
SPLASH splash10-014u-9160000000-9e3afdf0046a1c4a475e
Source of Spectrum E1-40-447-0
Wiley ID 1599151