| SpectraBase Compound ID | D49Su9cCUM9 |
|---|---|
| InChI | InChI=1S/C16H22ClNO/c1-2-3-6-15(18-11-4-5-12-18)16(19)13-7-9-14(17)10-8-13/h7-10,15H,2-6,11-12H2,1H3 |
| InChIKey | RRSPZEIKSCFOEE-UHFFFAOYSA-N |
| Mol Weight | 279.81 g/mol |
| Molecular Formula | C16H22ClNO |
| Exact Mass | 279.138992 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | sMUCeaSZEc |
|---|---|
| Name | 4-Chloro-alpha-pyrrolidinohexanophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.138992031 u |
| Formula | C16H22ClNO |
| InChI | InChI=1S/C16H22ClNO/c1-2-3-6-15(18-11-4-5-12-18)16(19)13-7-9-14(17)10-8-13/h7-10,15H,2-6,11-12H2,1H3 |
| InChIKey | RRSPZEIKSCFOEE-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=C(C1)Cl)C(C(N1CCCC1)CCCC)=O |