| SpectraBase Compound ID | JuGTvHN9AS6 |
|---|---|
| InChI | InChI=1S/C19H27NO3/c1-20-13-7-12-17(14-20)23-18(21)19(22,16-10-5-6-11-16)15-8-3-2-4-9-15/h2-4,8-9,16-17,22H,5-7,10-14H2,1H3 |
| InChIKey | SEWHBJAHHOCKER-UHFFFAOYSA-N |
| Mol Weight | 317.43 g/mol |
| Molecular Formula | C19H27NO3 |
| Exact Mass | 317.199094 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JbYwDEAFwEd |
|---|---|
| Name | 1-Methyl-3-piperidyl cyclopentylphenylglycolate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 317.199093730 u |
| Formula | C19H27NO3 |
| InChI | InChI=1S/C19H27NO3/c1-20-13-7-12-17(14-20)23-18(21)19(22,16-10-5-6-11-16)15-8-3-2-4-9-15/h2-4,8-9,16-17,22H,5-7,10-14H2,1H3 |
| InChIKey | SEWHBJAHHOCKER-UHFFFAOYSA-N |
| Molecular Weight | 317.429 g/mol |
| SMILES | C(=O)(OC1CCCN(C1)C)C(C1=CC=CC=C1)(O)C1CCCC1 |