| SpectraBase Compound ID | 2CG09yWDXEO |
|---|---|
| InChI | InChI=1S/C13H15NO2/c1-9(14-10(2)15)7-11-3-4-13-12(8-11)5-6-16-13/h3-6,8-9H,7H2,1-2H3,(H,14,15) |
| InChIKey | ZKZJFVDQYFXZHQ-UHFFFAOYSA-N |
| Mol Weight | 217.27 g/mol |
| Molecular Formula | C13H15NO2 |
| Exact Mass | 217.110279 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2AThWv1PmZ4 |
|---|---|
| Name | 5-apb ac |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.110278725 u |
| Formula | C13H15NO2 |
| InChI | InChI=1S/C13H15NO2/c1-9(14-10(2)15)7-11-3-4-13-12(8-11)5-6-16-13/h3-6,8-9H,7H2,1-2H3,(H,14,15) |
| InChIKey | ZKZJFVDQYFXZHQ-UHFFFAOYSA-N |
| Molecular Weight | 217.268 g/mol |
| SMILES | C1=2C(=CC(CC(NC(=O)C)C)=CC2)C=CO1 |