| SpectraBase Compound ID | 55bbk4ZVHvI |
|---|---|
| InChI | InChI=1S/C19H33NO3/c1-15(2)7-6-14-23-19(22)17-10-5-13-20(17)18(21)12-11-16-8-3-4-9-16/h15-17H,3-14H2,1-2H3 |
| InChIKey | DZRFKWQUHXYCPS-UHFFFAOYSA-N |
| Mol Weight | 323.5 g/mol |
| Molecular Formula | C19H33NO3 |
| Exact Mass | 323.246044 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FsNnPdCP7u9 |
|---|---|
| Name | L-Proline, N-(3-cyclopentylpropionyl)-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 323.246043924 u |
| Formula | C19H33NO3 |
| InChI | InChI=1S/C19H33NO3/c1-15(2)7-6-14-23-19(22)17-10-5-13-20(17)18(21)12-11-16-8-3-4-9-16/h15-17H,3-14H2,1-2H3 |
| InChIKey | DZRFKWQUHXYCPS-UHFFFAOYSA-N |
| Molecular Weight | 323.477 g/mol |
| SMILES | CC(C)CCCOC(C1N(CCC1)C(=O)CCC1CCCC1)=O |