| SpectraBase Compound ID | 7KCoekIFVHY |
|---|---|
| InChI | InChI=1S/C8H7N3O5/c1-4-6(10(13)14)2-5(8(9)12)3-7(4)11(15)16/h2-3H,1H3,(H2,9,12) |
| InChIKey | TXZXZIKHDOCRFD-UHFFFAOYSA-N |
| Mol Weight | 225.16 g/mol |
| Molecular Formula | C8H7N3O5 |
| Exact Mass | 225.03857 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | EJLgHErtDAp |
|---|---|
| Name | 4-Methyl-3,5-dinitro-benzamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7N3O5 |
| InChI | InChI=1S/C8H7N3O5/c1-4-6(10(13)14)2-5(8(9)12)3-7(4)11(15)16/h2-3H,1H3,(H2,9,12) |
| InChIKey | TXZXZIKHDOCRFD-UHFFFAOYSA-N |
| Molecular Weight | 225.160 g/mol |
| SMILES | NC(=O)c1cc(c(c(c1)N(=O)=O)C)N(=O)=O |
| SPLASH | splash10-0a4i-6790000000-316a20e9eaf918bcc801 |
| Source of Spectrum | RB-1982-14278-0 |
| Wiley ID | 1226125 |