| SpectraBase Compound ID | D6p8QfSIKEo |
|---|---|
| InChI | InChI=1S/C18H24ClNO3/c1-2-3-4-5-13-23-18(22)16-7-6-12-20(16)17(21)14-8-10-15(19)11-9-14/h8-11,16H,2-7,12-13H2,1H3 |
| InChIKey | AANQEDUTXPSAPD-UHFFFAOYSA-N |
| Mol Weight | 337.85 g/mol |
| Molecular Formula | C18H24ClNO3 |
| Exact Mass | 337.144471 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3mYANsxpU9T |
|---|---|
| Name | L-Proline, N-(4-chlorobenzoyl)-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 337.144471334 u |
| Formula | C18H24ClNO3 |
| InChI | InChI=1S/C18H24ClNO3/c1-2-3-4-5-13-23-18(22)16-7-6-12-20(16)17(21)14-8-10-15(19)11-9-14/h8-11,16H,2-7,12-13H2,1H3 |
| InChIKey | AANQEDUTXPSAPD-UHFFFAOYSA-N |
| Molecular Weight | 337.847 g/mol |
| SMILES | C1(CCCN1C(=O)C1=CC=C(C=C1)Cl)C(=O)OCCCCCC |