| SpectraBase Compound ID | 8NLhsGcDTQx |
|---|---|
| InChI | InChI=1S/C8H6N2O6/c1-4-6(8(11)12)2-5(9(13)14)3-7(4)10(15)16/h2-3H,1H3,(H,11,12) |
| InChIKey | CDVNZMKTJIBBBV-UHFFFAOYSA-N |
| Mol Weight | 226.14 g/mol |
| Molecular Formula | C8H6N2O6 |
| Exact Mass | 226.022586 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | zM2TK3MBs7 |
|---|---|
| Name | 3,5-Dinitro-o-toluic acid |
| Catalog Number | 211427 |
| Brand | ALDRICH |
| CAS Registry Number | 28169-46-2 |
| Copyright | Copyright © 2017-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H6N2O6 |
| Formula (reported) | C8H6N2O6 |
| InChI | InChI=1S/C8H6N2O6/c1-4-6(8(11)12)2-5(9(13)14)3-7(4)10(15)16/h2-3H,1H3,(H,11,12) |
| InChIKey | CDVNZMKTJIBBBV-UHFFFAOYSA-N |
| Purity | 98% |
| Wiley ID | SIAL_RAMAN_004608 |