| SpectraBase Compound ID | BkRCAVKPudh |
|---|---|
| InChI | InChI=1S/C13H17NO2/c15-10-12-8-4-5-9-14(12)13(16)11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10H2 |
| InChIKey | RGIJNYKDGHSPHP-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 | 3a9FwRPA09V |
|---|---|
| Name | (2-Methylolpiperidino)-phenyl-methanone |
| 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/c15-10-12-8-4-5-9-14(12)13(16)11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10H2 |
| InChIKey | RGIJNYKDGHSPHP-UHFFFAOYSA-N |
| Molecular Weight | 219.284 g/mol |
| SMILES | C(N1C(CO)CCCC1)(=O)C1=CC=CC=C1 |