| SpectraBase Compound ID | 7wKw2r9u6g |
|---|---|
| InChI | InChI=1S/C10H12N2O3/c1-7(2)10(13)11-8-3-5-9(6-4-8)12(14)15/h3-7H,1-2H3,(H,11,13) |
| InChIKey | BXRDRYLJKVRXHE-UHFFFAOYSA-N |
| Mol Weight | 208.22 g/mol |
| Molecular Formula | C10H12N2O3 |
| Exact Mass | 208.084792 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | DgvRKdpmWrT |
|---|---|
| Name | 4-Nitroaniline, N-(2-methylpropionyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.084792251 u |
| Formula | C10H12N2O3 |
| InChI | InChI=1S/C10H12N2O3/c1-7(2)10(13)11-8-3-5-9(6-4-8)12(14)15/h3-7H,1-2H3,(H,11,13) |
| InChIKey | BXRDRYLJKVRXHE-UHFFFAOYSA-N |
| Molecular Weight | 208.217 g/mol |
| SMILES | C1(NC(C(C)C)=O)=CC=C(C=C1)N(=O)=O |