![2-Pyridinamine, N-[2-(2,5-dimethylphenoxy)ethyl]-3-nitro-](/api/spectrum/1hmu7pR6h0P/structure.png?h=300&w=458 "2-Pyridinamine, N-[2-(2,5-dimethylphenoxy)ethyl]-3-nitro-")
| SpectraBase Compound ID | 2WR3FCAYaHk |
|---|---|
| InChI | InChI=1S/C15H17N3O3/c1-11-5-6-12(2)14(10-11)21-9-8-17-15-13(18(19)20)4-3-7-16-15/h3-7,10H,8-9H2,1-2H3,(H,16,17) |
| InChIKey | AYJFKTROOGYFID-UHFFFAOYSA-N |
| Mol Weight | 287.32 g/mol |
| Molecular Formula | C15H17N3O3 |
| Exact Mass | 287.126991 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1hmu7pR6h0P |
|---|---|
| Name | 2-Pyridinamine, N-[2-(2,5-dimethylphenoxy)ethyl]-3-nitro- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.126991416 u |
| Formula | C15H17N3O3 |
| InChI | InChI=1S/C15H17N3O3/c1-11-5-6-12(2)14(10-11)21-9-8-17-15-13(18(19)20)4-3-7-16-15/h3-7,10H,8-9H2,1-2H3,(H,16,17) |
| InChIKey | AYJFKTROOGYFID-UHFFFAOYSA-N |
| SMILES | C=1C(=C(N=CC1)NCCOC1=CC(=CC=C1C)C)N(=O)=O |