SpectraBase Compound ID | LisxV7od09c |
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InChI | InChI=1S/C7H6BrNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3 |
InChIKey | KZNXALJXBRSMFL-UHFFFAOYSA-N |
Mol Weight | 216.03 g/mol |
Molecular Formula | C7H6BrNO2 |
Exact Mass | 214.958191 g/mol |
SpectraBase Spectrum ID | 9m8aW0VqL3N |
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Name | 4-Bromo-2-nitrotoluene |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 425230 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C7H6BrNO2 |
InChI | InChI=1S/C7H6BrNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3 |
InChIKey | KZNXALJXBRSMFL-UHFFFAOYSA-N |
Molecular Weight | 216.034 g/mol |
Observed nucleus | 13C |
Purity | 97% |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_014322 |