| SpectraBase Compound ID | 2FLxcHEo8m1 |
|---|---|
| InChI | InChI=1S/C13H15NO2/c1-9(14-10(2)15)8-11-4-3-5-13-12(11)6-7-16-13/h3-7,9H,8H2,1-2H3,(H,14,15) |
| InChIKey | ZGERXUCBEZJUDY-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 | 9bmy8N8KloS |
|---|---|
| Name | 4-apb Acetyl derivative |
| 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)8-11-4-3-5-13-12(11)6-7-16-13/h3-7,9H,8H2,1-2H3,(H,14,15) |
| InChIKey | ZGERXUCBEZJUDY-UHFFFAOYSA-N |
| Molecular Weight | 217.268 g/mol |
| SMILES | N(C(CC=1C=CC=C2OC=CC12)C)C(=O)C |