| 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)
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| SpectraBase Spectrum ID | FKcg9cUcXAi |
|---|---|
| Name | 3-Bromo-5-nitrotoluene |
| 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 |
| Synonyms | 1-Bromanyl-3-methyl-5-nitro-benzene 1-Bromo-3-methyl-5-nitro-benzene |
| Wiley ID | 1599151 |