| SpectraBase Compound ID | 9Zctm7embxm |
|---|---|
| InChI | InChI=1S/C13H17NO2/c1-16-12-6-4-11(5-7-12)13(15)10-14-8-2-3-9-14/h4-7H,2-3,8-10H2,1H3 |
| InChIKey | QETPKNUGDGIITI-UHFFFAOYSA-N |
| Mol Weight | 219.28 g/mol |
| Molecular Formula | C13H17NO2 |
| Exact Mass | 219.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2kTdFaeGmwN |
|---|---|
| Name | 2-Pyrrolidino-4'-methoxyacetophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.125928789 u |
| Formula | C13H17NO2 |
| InChI | InChI=1S/C13H17NO2/c1-16-12-6-4-11(5-7-12)13(15)10-14-8-2-3-9-14/h4-7H,2-3,8-10H2,1H3 |
| InChIKey | QETPKNUGDGIITI-UHFFFAOYSA-N |
| Molecular Weight | 219.284 g/mol |
| SMILES | C=1(C(CN2CCCC2)=O)C=CC(=CC1)OC |