| SpectraBase Compound ID | 9DJRHYSwF86 |
|---|---|
| InChI | InChI=1S/C12H15NO3/c1-9(14)13(2)6-5-10-3-4-11-12(7-10)16-8-15-11/h3-4,7H,5-6,8H2,1-2H3 |
| InChIKey | DCPRWJJUFSDLGE-UHFFFAOYSA-N |
| Mol Weight | 221.26 g/mol |
| Molecular Formula | C12H15NO3 |
| Exact Mass | 221.105193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Exk7ierpzwS |
|---|---|
| Name | Homarylamine ac |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.105193344 u |
| Formula | C12H15NO3 |
| InChI | InChI=1S/C12H15NO3/c1-9(14)13(2)6-5-10-3-4-11-12(7-10)16-8-15-11/h3-4,7H,5-6,8H2,1-2H3 |
| InChIKey | DCPRWJJUFSDLGE-UHFFFAOYSA-N |
| Molecular Weight | 221.256 g/mol |
| SMILES | C1=2C(=CC=C(C2)CCN(C(=O)C)C)OCO1 |