| SpectraBase Compound ID | 7CDfvhirZQP |
|---|---|
| InChI | InChI=1S/C8H6BrNO4/c1-4-2-3-5(8(11)12)7(6(4)9)10(13)14/h2-3H,1H3,(H,11,12) |
| InChIKey | JZFRBFOZDYWGCP-UHFFFAOYSA-N |
| Mol Weight | 260.04 g/mol |
| Molecular Formula | C8H6BrNO4 |
| Exact Mass | 258.948021 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3LYAwYJPjAT |
|---|---|
| Name | 3-Bromo-4-methyl-2-nitrobenzoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6BrNO4 |
| InChI | InChI=1S/C8H6BrNO4/c1-4-2-3-5(8(11)12)7(6(4)9)10(13)14/h2-3H,1H3,(H,11,12) |
| InChIKey | JZFRBFOZDYWGCP-UHFFFAOYSA-N |
| Molecular Weight | 260.043 g/mol |
| SMILES | OC(c1c(N(=O)=O)c(c(cc1)C)Br)=O |
| SPLASH | splash10-056r-9470000000-f3641ba98afc9d53adc8 |
| Source of Spectrum | F-56-8744-40 |
| Wiley ID | 859108 |