| SpectraBase Compound ID | 39Iui0p4Gu7 |
|---|---|
| InChI | InChI=1S/C16H23NO2/c18-16(19-13-15-9-5-11-17-12-15)10-4-3-8-14-6-1-2-7-14/h5,9,11-12,14H,1-4,6-8,10,13H2 |
| InChIKey | AOQWRKFUXFTUQN-UHFFFAOYSA-N |
| Mol Weight | 261.36 g/mol |
| Molecular Formula | C16H23NO2 |
| Exact Mass | 261.172879 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Ho9D8NUbMh |
|---|---|
| Name | Picolinyl 5-cyclopentylpentanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 261.172878983 u |
| Formula | C16H23NO2 |
| InChI | InChI=1S/C16H23NO2/c18-16(19-13-15-9-5-11-17-12-15)10-4-3-8-14-6-1-2-7-14/h5,9,11-12,14H,1-4,6-8,10,13H2 |
| InChIKey | AOQWRKFUXFTUQN-UHFFFAOYSA-N |
| Molecular Weight | 261.365 g/mol |
| SMILES | C1=CN=CC(=C1)COC(CCCCC1CCCC1)=O |