| SpectraBase Compound ID | 8Pgfx46y29E |
|---|---|
| InChI | InChI=1S/C14H24ClNO2/c15-8-3-7-14(17)18-11-12-5-4-10-16-9-2-1-6-13(12)16/h12-13H,1-11H2 |
| InChIKey | TXFMNDVUFFVBMF-UHFFFAOYSA-N |
| Mol Weight | 273.8 g/mol |
| Molecular Formula | C14H24ClNO2 |
| Exact Mass | 273.149557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FyeddItEj0 |
|---|---|
| Name | (1R,9ar)-Octahydro-2H-quinolizin-1-ylmethyl 4-chlorobutanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.149556715 u |
| Formula | C14H24ClNO2 |
| InChI | InChI=1S/C14H24ClNO2/c15-8-3-7-14(17)18-11-12-5-4-10-16-9-2-1-6-13(12)16/h12-13H,1-11H2 |
| InChIKey | TXFMNDVUFFVBMF-UHFFFAOYSA-N |
| SMILES | C1CCN2C(C(COC(=O)CCCCl)CCC2)C1 |